3D Periodic Editor 3D Molecular And Reaction Editor Expert Editor Microsoft Quantum Editor EMSL Aerosol Workshop Editor Manual 3D Periodic Editor 3D Molecular And Reaction Editor Expert Editor Microsoft Quantum Editor EMSL Aerosol Workshop Editor Manual Results from an EMSL Arrows Calculation
| EMSL Arrows is a revolutionary approach to materials and chemical simulations that uses NWChem and chemical computational databases to make materials and chemical modeling accessible via a broad spectrum of digital communications including posts to web APIs, social networks, and traditional email. |
Molecular modeling software has previously been extremely complex, making it prohibative to all but experts in the field, yet even experts can struggle to perform calculations. This service is designed to be used by experts and non-experts alike. Experts can carry out and keep track of large numbers of complex calculations with diverse levels of theories present in their workflows. Additionally, due to a streamlined and easy-to-use input, non-experts can carry out a wide variety of molecular modeling calculations previously not accessible to them.
The id(s) for emsiles = O=C1C=CC(=O)[C]([CH]1)N([O])O theory{dft} xc{b3lyp} basis{6-311++G(2d,2p)} solvation_type{COSMO} ^{-1} are: 59754
Use id=% instead of esmiles to print other entries.
mformula = C6H4N1O4
iupac = O=C1C=CC(=O)[C]([CH]1)N([O])O anion
Search Links to Other Online Resources (may not be available):
- Google Structure Search
- EPA CompTox Database
- Chemical Entities of Biological Interest (ChEBI)
- NIH ChemIDplus - A TOXNET DATABASE
- The Human Metabolome Database (HMDB)
- OECD eChemPortal
- Google Scholar
+==================================================+
|| Molecular Calculation ||
+==================================================+
Id = 59754
NWOutput = Link to NWChem Output (download)
Datafiles:
homo-restricted.cube-903388-2021-1-6-12:37:2 (download)
lumo-restricted.cube-903388-2021-1-6-12:37:2 (download)
cosmo.xyz-903388-2021-1-6-12:37:2 (download)
mo_orbital_nwchemarrows.out-370285-2021-1-27-23:37:2 (download)
image_resset: api/image_reset/59754
Calculation performed by Eric Bylaska - arrow10.emsl.pnl.gov
Numbers of cpus used for calculation = 32
Calculation walltime = 26946.400000 seconds (0 days 7 hours 29 minutes 6 seconds)
+----------------+
| Energetic Data |
+----------------+
Id = 59754
iupac = O=C1C=CC(=O)[C]([CH]1)N([O])O anion
mformula = C6H4N1O4
inchi = InChI=1S/C6H4NO4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,10H
inchikey = OOHAUONATLQPBQ-UHFFFAOYSA-N
esmiles = O=C1C=CC(=O)[C]([CH]1)N([O])O theory{dft} xc{b3lyp} basis{6-311++G(2d,2p)} solvation_type{COSMO} ^{-1}
calculation_type = ovc
theory = dft
xc = b3lyp
basis = 6-311++G(2d,2p)
charge,mult = -1 1
energy = -586.821405 Hartrees
enthalpy correct.= 0.106109 Hartrees
entropy = 93.871 cal/mol-K
solvation energy = -63.967 kcal/mol solvation_type = COSMO
Sitkoff cavity dispersion = 2.373 kcal/mol
Honig cavity dispersion = 7.564 kcal/mol
ASA solvent accesible surface area = 302.545 Angstrom2
ASA solvent accesible volume = 289.760 Angstrom3
+-----------------+
| Structural Data |
+-----------------+
JSmol: an open-source HTML5 viewer for chemical structures in 3D
Number of Atoms = 15
Units are Angstrom for bonds and degrees for angles
Type I J K L M Value
----------- ----- ----- ----- ----- ----- ----------
1 Stretch O1 C2 1.26082
2 Stretch C2 C3 1.40800
3 Stretch C2 C8 1.48025
4 Stretch C3 C4 1.42668
5 Stretch C3 H13 1.08091
6 Stretch C4 C5 1.49103
7 Stretch C4 N9 1.34325
8 Stretch C5 O6 1.22979
9 Stretch C5 C7 1.46748
10 Stretch C7 C8 1.34398
11 Stretch C7 H14 1.08298
12 Stretch C8 H15 1.08436
13 Stretch N9 O10 1.44641
14 Stretch N9 O12 1.23618
15 Stretch O10 H11 0.97182
16 Bend O1 C2 C3 125.81903
17 Bend O1 C2 C8 118.72657
18 Bend C3 C2 C8 115.43976
19 Bend C2 C3 C4 122.67764
20 Bend C2 C3 H13 116.11035
21 Bend C4 C3 H13 120.69531
22 Bend C3 C4 C5 121.04845
23 Bend C3 C4 N9 121.91973
24 Bend C5 C4 N9 116.83130
25 Bend C4 C5 O6 125.11395
26 Bend C4 C5 C7 114.18217
27 Bend O6 C5 C7 120.68437
28 Bend C5 C7 C8 122.83919
29 Bend C5 C7 H14 114.85505
30 Bend C8 C7 H14 122.29978
31 Bend C2 C8 C7 123.56468
32 Bend C2 C8 H15 115.29479
33 Bend C7 C8 H15 121.11611
34 Bend C4 N9 O10 115.53848
35 Bend C4 N9 O12 131.15548
36 Bend O10 N9 O12 113.30598
37 Bend N9 O10 H11 103.60089
38 Dihedral O1 C2 C3 C4 -177.55657
39 Dihedral O1 C2 C3 H13 -5.75994
40 Dihedral O1 C2 C8 C7 175.36221
41 Dihedral O1 C2 C8 H15 -2.85479
42 Dihedral C2 C3 C4 C5 3.42747
43 Dihedral C2 C3 C4 N9 -171.26282
44 Dihedral C2 C8 C7 C5 0.98953
45 Dihedral C2 C8 C7 H14 -178.07511
46 Dihedral C3 C2 C8 C7 -3.32737
47 Dihedral C3 C2 C8 H15 178.45563
48 Dihedral C3 C4 C5 O6 176.11621
49 Dihedral C3 C4 C5 C7 -5.48884
50 Dihedral C3 C4 N9 O10 7.69631
51 Dihedral C3 C4 N9 O12 -172.40736
52 Dihedral C4 C3 C2 C8 1.02624
53 Dihedral C4 C5 C7 C8 3.36232
54 Dihedral C4 C5 C7 H14 -177.50901
55 Dihedral C4 N9 O10 H11 22.70980
56 Dihedral C5 C4 C3 H13 -168.00346
57 Dihedral C5 C4 N9 O10 -167.20643
58 Dihedral C5 C4 N9 O12 12.68990
59 Dihedral C5 C7 C8 H15 179.10652
60 Dihedral O6 C5 C4 N9 -8.93367
61 Dihedral O6 C5 C7 C8 -178.16436
62 Dihedral O6 C5 C7 H14 0.96431
63 Dihedral C7 C5 C4 N9 169.46127
64 Dihedral C8 C2 C3 H13 172.82288
65 Dihedral N9 C4 C3 H13 17.30625
66 Dihedral H11 O10 N9 O12 -157.20522
67 Dihedral H14 C7 C8 H15 0.04188
+-----------------+
| Eigenvalue Data |
+-----------------+
Id = 59754
iupac = O=C1C=CC(=O)[C]([CH]1)N([O])O anion
mformula = C6H4N1O4
InChI = InChI=1S/C6H4NO4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,10H
smiles = O=C1C=CC(=O)[C]([CH]1)N([O])O
esmiles = O=C1C=CC(=O)[C]([CH]1)N([O])O theory{dft} xc{b3lyp} basis{6-311++G(2d,2p)} solvation_type{COSMO} ^{-1}
theory = dft
xc = b3lyp
basis = 6-311++G(2d,2p)
charge = -1
mult = 1
solvation_type = COSMO
twirl webpage = TwirlMol Link
image webpage = GIF Image Link
Eigevalue Spectra
---- ---- 65.96 eV
----------
--- -- ---
---- ----
-- -- -- -
----------
--- -- ---
--- -- ---
---- ----
-- -- -- -
---- ----
-- -- -- -
- - - - --
- - - - --
6 - - - -
7 - - - -
7 - - - -
9 - - - -
- - - - --
-- -- -- -
-- -- -- -
6 - - - -
- - - - --
8 - - - -
7 - - - -
6 - - - -
6 - - - -
8 - - - -
13 - - - -
10 - - - -
13 - - - -
9 - - - -
- - - - --
---------- LUMO= -3.02 eV
HOMO= -5.31 eV ++++++++++
++++++++++
++ ++ ++ +
++ ++ ++ +
++ ++ ++ +
+ + + + ++
++++++++++
++++ ++++
++++++++++
++++++++++
++++++++++
+++ ++ +++
-32.42 eV ++++++++++
spin eig occ ---------------------------- restricted -32.42 2.00 restricted -28.86 2.00 restricted -28.59 2.00 restricted -27.48 2.00 restricted -24.02 2.00 restricted -22.33 2.00 restricted -20.00 2.00 restricted -18.87 2.00 restricted -17.41 2.00 restricted -16.52 2.00 restricted -15.22 2.00 restricted -14.27 2.00 restricted -14.13 2.00 restricted -13.54 2.00 restricted -13.41 2.00 restricted -12.58 2.00 restricted -11.97 2.00 restricted -11.71 2.00 restricted -11.55 2.00 restricted -11.17 2.00 restricted -10.70 2.00 restricted -10.49 2.00 restricted -9.61 2.00 restricted -8.90 2.00 restricted -8.25 2.00 restricted -7.85 2.00 restricted -7.53 2.00 restricted -7.01 2.00 restricted -5.31 2.00 restricted -3.02 0.00 restricted -0.30 0.00 restricted -0.24 0.00 restricted 0.21 0.00 restricted 0.38 0.00 restricted 0.47 0.00 restricted 0.88 0.00 restricted 1.04 0.00 restricted 1.33 0.00 restricted 1.42 0.00 restricted 1.64 0.00 restricted 1.85 0.00 restricted 2.14 0.00 restricted 2.23 0.00 restricted 2.44 0.00 restricted 2.86 0.00 restricted 3.06 0.00 restricted 3.13 0.00 restricted 3.22 0.00 restricted 3.43 0.00 restricted 3.49 0.00 restricted 3.52 0.00 restricted 3.64 0.00 restricted 3.79 0.00 restricted 3.96 0.00 restricted 3.98 0.00 restricted 4.57 0.00 restricted 4.60 0.00 restricted 4.82 0.00 restricted 4.98 0.00 restricted 5.06 0.00 restricted 5.14 0.00 restricted 5.23 0.00 restricted 5.37 0.00 restricted 5.77 0.00 restricted 5.92 0.00 restricted 6.37 0.00 restricted 6.62 0.00 restricted 6.77 0.00 restricted 6.93 0.00 restricted 7.02 0.00 restricted 7.05 0.00 restricted 7.39 0.00 restricted 7.61 0.00 restricted 7.76 0.00 restricted 7.86 0.00 restricted 7.94 0.00 restricted 8.28 0.00 restricted 8.34 0.00 restricted 8.47 0.00 restricted 8.71 0.00 restricted 8.78 0.00 restricted 9.09 0.00 restricted 9.51 0.00 restricted 9.73 0.00 restricted 9.94 0.00 restricted 10.22 0.00 restricted 10.44 0.00 restricted 10.56 0.00 restricted 10.91 0.00 restricted 10.95 0.00 restricted 11.62 0.00 restricted 12.05 0.00 restricted 12.42 0.00 restricted 12.71 0.00 restricted 13.31 0.00 restricted 13.60 0.00 restricted 13.68 0.00 restricted 14.14 0.00 restricted 14.51 0.00 restricted 14.70 0.00 restricted 15.20 0.00 restricted 15.60 0.00 restricted 15.63 0.00 restricted 15.87 0.00 restricted 16.13 0.00 restricted 16.45 0.00 restricted 16.58 0.00 restricted 16.85 0.00 restricted 17.12 0.00 restricted 17.30 0.00 restricted 17.48 0.00 restricted 17.82 0.00 restricted 18.34 0.00 restricted 18.41 0.00 restricted 18.75 0.00 restricted 19.02 0.00 restricted 19.27 0.00 restricted 19.50 0.00 restricted 19.88 0.00 restricted 20.65 0.00 restricted 21.18 0.00 restricted 21.24 0.00 restricted 21.69 0.00 restricted 21.94 0.00 restricted 22.39 0.00 restricted 22.59 0.00 restricted 22.98 0.00 restricted 24.32 0.00 restricted 24.45 0.00 restricted 24.72 0.00 restricted 25.36 0.00 restricted 25.67 0.00 restricted 25.83 0.00 restricted 26.51 0.00 restricted 27.11 0.00 restricted 27.55 0.00 restricted 27.83 0.00 restricted 28.36 0.00 restricted 28.49 0.00 restricted 28.87 0.00 restricted 29.17 0.00 restricted 29.48 0.00 restricted 29.52 0.00 restricted 29.91 0.00 restricted 30.13 0.00 restricted 30.28 0.00 restricted 30.41 0.00 restricted 30.64 0.00 restricted 30.84 0.00 restricted 31.20 0.00 restricted 31.47 0.00 restricted 31.86 0.00 restricted 32.14 0.00 restricted 32.26 0.00 restricted 32.65 0.00 restricted 33.11 0.00 restricted 33.48 0.00 restricted 33.70 0.00 restricted 33.91 0.00 restricted 34.14 0.00 restricted 34.35 0.00 restricted 34.48 0.00 restricted 34.98 0.00 restricted 35.40 0.00 restricted 35.88 0.00 restricted 36.13 0.00 restricted 36.27 0.00 restricted 36.44 0.00 restricted 37.22 0.00 restricted 37.44 0.00 restricted 37.87 0.00 restricted 38.03 0.00 restricted 38.29 0.00 restricted 39.28 0.00 restricted 39.54 0.00 restricted 39.59 0.00 restricted 40.54 0.00 restricted 40.80 0.00 restricted 41.12 0.00 restricted 41.66 0.00 restricted 41.72 0.00 restricted 42.45 0.00 restricted 43.55 0.00 restricted 44.74 0.00 restricted 45.31 0.00 restricted 45.83 0.00 restricted 46.44 0.00 restricted 46.56 0.00 restricted 47.22 0.00 restricted 48.16 0.00 restricted 49.03 0.00 restricted 49.23 0.00 restricted 50.73 0.00 restricted 51.03 0.00 restricted 52.37 0.00 restricted 52.86 0.00 restricted 53.56 0.00 restricted 54.96 0.00 restricted 55.24 0.00 restricted 56.38 0.00 restricted 56.63 0.00 restricted 57.95 0.00 restricted 58.28 0.00 restricted 59.58 0.00 restricted 60.60 0.00 restricted 60.85 0.00 restricted 62.15 0.00 restricted 64.97 0.00 restricted 65.96 0.00
+----------------------------------------+ | Vibrational Density of States Analysis | +----------------------------------------+ Total number of frequencies = 45 Total number of negative frequencies = 0 Number of lowest frequencies = 11 (frequency threshold = 500 ) Exact dos norm = 39.000 Generating vibrational DOS Generating model vibrational DOS to have a proper norm 10.00 38.99 11.00 39.00 50.00 38.94 10.94 39.00 100.00 38.57 10.57 39.00 Generating IR Spectra Writing vibrational density of states (DOS) to vdos.dat Writing model vibrational density of states (DOS_FIXED) to vdos-model.dat Writing IR spectra to irdos.dat Temperature= 298.15 zero-point correction to energy = 60.239 kcal/mol ( 0.095997) vibrational contribution to enthalpy correction = 64.216 kcal/mol ( 0.102334) vibrational contribution to Entropy = 22.819 cal/mol-k hindered rotor enthalpy correction = 0.000 kcal/mol ( 0.000000) hindered rotor entropy correction = 0.000 cal/mol-k
DOS sigma = 10.000000
- vibrational DOS enthalpy correction = 0.102337 kcal/mol ( 64.217 kcal/mol)
- model vibrational DOS enthalpy correction = 0.102346 kcal/mol ( 64.223 kcal/mol)
- vibrational DOS Entropy = 0.000036 ( 22.858 cal/mol-k)
- model vibrational DOS Entropy = 0.000036 ( 22.873 cal/mol-k)
- original gas Energy = -586.821405 (-368235.989 kcal/mol)
- original gas Enthalpy = -586.715296 (-368169.404 kcal/mol, delta= 0.000)
- unajusted DOS gas Enthalpy = -586.715294 (-368169.403 kcal/mol, delta= 0.002)
- model DOS gas Enthalpy = -586.715284 (-368169.397 kcal/mol, delta= 0.008)
- original gas Entropy = 0.000150 ( 93.871 cal/mol-k,delta= 0.000)
- unajusted DOS gas Entropy = 0.000150 ( 93.910 cal/mol-k,delta= 0.039)
- model DOS gas Entropy = 0.000150 ( 93.925 cal/mol-k,delta= 0.054)
- original gas Free Energy = -586.759898 (-368197.392 kcal/mol, delta= 0.000)
- unadjusted DOS gas Free Energy = -586.759914 (-368197.402 kcal/mol, delta= -0.010)
- model DOS gas Free Energy = -586.759911 (-368197.400 kcal/mol, delta= -0.008)
- original sol Free Energy = -586.861836 (-368261.359 kcal/mol)
- unadjusted DOS sol Free Energy = -586.861852 (-368261.369 kcal/mol)
- model DOS sol Free Energy = -586.861849 (-368261.368 kcal/mol)
DOS sigma = 50.000000
- vibrational DOS enthalpy correction = 0.102346 kcal/mol ( 64.223 kcal/mol)
- model vibrational DOS enthalpy correction = 0.102418 kcal/mol ( 64.268 kcal/mol)
- vibrational DOS Entropy = 0.000038 ( 23.793 cal/mol-k)
- model vibrational DOS Entropy = 0.000038 ( 23.908 cal/mol-k)
- original gas Energy = -586.821405 (-368235.989 kcal/mol)
- original gas Enthalpy = -586.715296 (-368169.404 kcal/mol, delta= 0.000)
- unajusted DOS gas Enthalpy = -586.715285 (-368169.397 kcal/mol, delta= 0.008)
- model DOS gas Enthalpy = -586.715212 (-368169.351 kcal/mol, delta= 0.053)
- original gas Entropy = 0.000150 ( 93.871 cal/mol-k,delta= 0.000)
- unajusted DOS gas Entropy = 0.000151 ( 94.845 cal/mol-k,delta= 0.974)
- model DOS gas Entropy = 0.000151 ( 94.960 cal/mol-k,delta= 1.089)
- original gas Free Energy = -586.759898 (-368197.392 kcal/mol, delta= 0.000)
- unadjusted DOS gas Free Energy = -586.760348 (-368197.675 kcal/mol, delta= -0.283)
- model DOS gas Free Energy = -586.760331 (-368197.664 kcal/mol, delta= -0.272)
- original sol Free Energy = -586.861836 (-368261.359 kcal/mol)
- unadjusted DOS sol Free Energy = -586.862287 (-368261.642 kcal/mol)
- model DOS sol Free Energy = -586.862269 (-368261.631 kcal/mol)
DOS sigma = 100.000000
- vibrational DOS enthalpy correction = 0.102193 kcal/mol ( 64.127 kcal/mol)
- model vibrational DOS enthalpy correction = 0.102693 kcal/mol ( 64.441 kcal/mol)
- vibrational DOS Entropy = 0.000038 ( 23.544 cal/mol-k)
- model vibrational DOS Entropy = 0.000039 ( 24.340 cal/mol-k)
- original gas Energy = -586.821405 (-368235.989 kcal/mol)
- original gas Enthalpy = -586.715296 (-368169.404 kcal/mol, delta= 0.000)
- unajusted DOS gas Enthalpy = -586.715438 (-368169.493 kcal/mol, delta= -0.089)
- model DOS gas Enthalpy = -586.714938 (-368169.179 kcal/mol, delta= 0.225)
- original gas Entropy = 0.000150 ( 93.871 cal/mol-k,delta= 0.000)
- unajusted DOS gas Entropy = 0.000151 ( 94.596 cal/mol-k,delta= 0.725)
- model DOS gas Entropy = 0.000152 ( 95.391 cal/mol-k,delta= 1.520)
- original gas Free Energy = -586.759898 (-368197.392 kcal/mol, delta= 0.000)
- unadjusted DOS gas Free Energy = -586.760384 (-368197.697 kcal/mol, delta= -0.305)
- model DOS gas Free Energy = -586.760262 (-368197.620 kcal/mol, delta= -0.228)
- original sol Free Energy = -586.861836 (-368261.359 kcal/mol)
- unadjusted DOS sol Free Energy = -586.862322 (-368261.664 kcal/mol)
- model DOS sol Free Energy = -586.862200 (-368261.588 kcal/mol)
Normal Mode Frequency (cm-1) IR Intensity (arbitrary)
----------- ---------------- ------------------------
1 0.000 0.072
2 0.000 0.250
3 0.000 0.985
4 0.000 1.073
5 0.000 0.397
6 0.000 0.670
7 85.730 1.471
8 104.810 0.570
9 144.390 1.219
10 222.540 0.867
11 294.380 0.315
12 333.280 1.200
13 378.640 1.075
14 408.620 7.815
15 419.650 4.220
16 423.300 3.674
17 473.260 5.058
18 526.360 0.964
19 552.470 0.151
20 604.420 3.788
21 615.580 3.505
22 685.820 8.874
23 709.970 3.221
24 786.600 1.899
25 793.280 2.787
26 862.520 7.576
27 870.840 13.445
28 939.010 1.247
29 1008.060 0.603
30 1112.020 6.001
31 1193.460 21.170
32 1224.740 34.885
33 1295.840 16.116
34 1311.640 7.160
35 1354.420 8.777
36 1404.380 1.781
37 1428.560 0.695
38 1554.840 121.646
39 1565.060 65.247
40 1640.070 40.672
41 1693.710 25.449
42 3146.960 7.769
43 3164.550 7.110
44 3172.750 3.447
45 3651.450 3.083
No Hindered Rotor Data
+-------------------------------------+
| Reactions Contained in the Database |
+-------------------------------------+
Reactions Containing INCHIKEY = OOHAUONATLQPBQ-UHFFFAOYSA-N
Reactionid Erxn(gas) Hrxn(gas) Grxn(gas) delta_Solv Grxn(aq) ReactionType Reaction
5646 18.067 17.354 17.374 2.895 20.269 AB + C --> AC + B "Oc1ccc(c(c1)N(=O)=O)[O] ^{-1} --> [O][C]1C=CC(=O)C(=C1)N(O)[O] ^{-1}"
All requests to Arrows were successful.
KEYWORDs -
reaction: :reaction
chinese_room: :chinese_room
molecule: :molecule
nmr: :nmr
predict: :predict
submitesmiles: :submitesmiles
nosubmitmissingesmiles
resubmitmissingesmiles
submitmachines: :submitmachines
useallentries
nomodelcorrect
eigenvalues: :eigenvalues
frequencies: :frequencies
nwoutput: :nwoutput
xyzfile: :xyzfile
alleigs: :alleigs
allfreqs: :allfreqs
reactionenumerate:
energytype:[erxn(gas) hrxn(gas) grxn(gas) delta_solvation grxn(aq)] :energytype
energytype:[kcal/mol kj/mol ev cm-1 ry hartree au] :energytype
tablereactions:
reaction: ... :reaction
reaction: ... :reaction
...
:tablereactions
tablemethods:
method: ... :method
method: ... :method
...
:tablemethods
:reactionenumerate
rotatebonds
xyzinput:
label: :label
xyzdata:
... xyz data ...
:xyzdata
:xyzinput
submitHf: :submitHf
nmrexp: :nmrexp
findreplace: old text | new text :findreplace
listnwjobs
fetchnwjob: :fetchnwjob
pushnwjob: :pushnwjob
printcsv: :printcsv
printeig: :printeig
printfreq: :printfreq
printxyz: :printxyz
printjobinfo: :printjobinfo
printnwout: :printnwout
badids: :badids
hup_string:
database:
table:
request_table:
listallesmiles
queuecheck
This software service and its documentation were developed at the Environmental Molecular Sciences Laboratory (EMSL) at Pacific Northwest National Laboratory, a multiprogram national laboratory, operated for the U.S. Department of Energy by Battelle under Contract Number DE-AC05-76RL01830. Support for this work was provided by the Department of Energy Office of Biological and Environmental Research, and Department of Defense environmental science and technology program (SERDP). THE SOFTWARE SERVICE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY, FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM, OUT OF OR IN CONNECTION WITH THE SOFTWARE SERVICE OR THE USE OR OTHER DEALINGS IN THE SOFTWARE SERVICE.