List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
196995 |
78907166 |
1 |
NOC11H19 |
ABC11D19 |
-62.85 |
3.6 |
-9.53 |
0.28 |
0 |
|
|
196996 |
78907167 |
1 |
NO2C10H13 |
AB2C10D13 |
-44.79 |
3.77 |
-9.25 |
0.11 |
0 |
|
|
196997 |
78907168 |
1 |
ON2C10H20 |
AB2C10D20 |
-51.87 |
4.74 |
-8.65 |
0.27 |
0 |
|
|
196998 |
78907421 |
1 |
ON4C16H18 |
AB4C16D18 |
46.29 |
1.13 |
-8.43 |
0.02 |
0 |
|
|
196999 |
78907573 |
1 |
NSBr2H11C16 |
ABC2D11E16 |
78.6 |
1.88 |
-9.1 |
-1.18 |
0 |
|
|
197000 |
78907659 |
1 |
NSO4C8H9 |
ABC4D8E9 |
-71.86 |
5.57 |
-10.1 |
-2.18 |
0 |
|
|
197001 |
78907861 |
1 |
ClO2C13H15 |
AB2C13D15 |
-69.57 |
2.63 |
-9.52 |
-0.31 |
0 |
|
|
197002 |
78907948 |
1 |
FNO4C11H14 |
ABC4D11E14 |
-125.75 |
4.44 |
-9.97 |
-1.25 |
0 |
|
|
197003 |
78907949 |
1 |
SO2C13H18 |
AB2C13D18 |
-92.79 |
3.53 |
-9.01 |
-0.67 |
0 |
|
|
197004 |
78908229 |
2 |
NOC7H11 |
ABC7D11 |
-81.5 |
3.47 |
-8.4 |
0.57 |
0 |
|
|
197005 |
78908490 |
1 |
N3O3C11H13 |
A3B3C11D13 |
-10.7 |
9.43 |
-9.63 |
-1.26 |
0 |
|
|
197006 |
78908626 |
1 |
ON2Cl3H9C11 |
AB2C3D9E11 |
15.47 |
5.16 |
-9.06 |
-0.8 |
0 |
|
|
197007 |
78908627 |
1 |
N2O3C13H16 |
A2B3C13D16 |
-39.67 |
0.75 |
-8.36 |
-0.16 |
0 |
|
|
197008 |
78908628 |
1 |
ON2C13H16 |
AB2C13D16 |
18.8 |
2.97 |
-9.4 |
0.31 |
0 |
|
|
197009 |
78908889 |
1 |
SCl2N2H10C14 |
AB2C2D10E14 |
47.48 |
2.35 |
-8.64 |
-0.89 |
0 |
|
|
197010 |
78909260 |
1 |
N2O2C11H20 |
A2B2C11D20 |
-95.72 |
0.66 |
-9.01 |
0.57 |
0 |
|
|
197011 |
78909261 |
1 |
OSC9H12 |
ABC9D12 |
-29.96 |
2.91 |
-8.91 |
0.28 |
0 |
|
|
197012 |
78909398 |
1 |
NO4C16H17 |
AB4C16D17 |
-126.73 |
5.83 |
-8.28 |
-0.27 |
0 |
|
|
197013 |
78909399 |
1 |
NOC8H19 |
ABC8D19 |
-76.48 |
3.21 |
-9.01 |
2.81 |
0 |
|
|
197014 |
78909541 |
1 |
NO2C13H17 |
AB2C13D17 |
-88.89 |
4.65 |
-8.79 |
0.11 |
0 |
|
|
197015 |
78909619 |
1 |
NO3C16H27 |
AB3C16D27 |
-167.38 |
4.24 |
-9.55 |
1.34 |
0 |
|
|
197016 |
78909620 |
1 |
NO3C11H21 |
AB3C11D21 |
-155.28 |
2.97 |
-9.66 |
1.1 |
0 |
|
|
197017 |
78909621 |
1 |
NSO3C12H17 |
ABC3D12E17 |
-103.7 |
4.69 |
-8.5 |
-0.24 |
0 |
|
|
197018 |
78909622 |
1 |
NOC9H17 |
ABC9D17 |
-64.8 |
4.09 |
-9.16 |
1.27 |
0 |
|
|
197019 |
78909680 |
1 |
FNO3C13H18 |
ABC3D13E18 |
-164.1 |
1.85 |
-9.64 |
-0.42 |
0 |
|
|
197020 |
78909711 |
1 |
NO3C15H23 |
AB3C15D23 |
-138.28 |
2.85 |
-9.07 |
0.11 |
0 |
|
|
197021 |
78909712 |
1 |
NO3C15H29 |
AB3C15D29 |
-176.46 |
3.95 |
-9.52 |
1.44 |
0 |
|
|
197022 |
78909750 |
1 |
NO3C15H23 |
AB3C15D23 |
-131.21 |
2.79 |
-9.37 |
0.38 |
0 |
|
|
197023 |
78910000 |
1 |
SO2N5C9H13 |
AB2C5D9E13 |
-72.03 |
4.56 |
-9.26 |
-0.52 |
0 |
|
|
197024 |
78910078 |
1 |
ClN2H13C15 |
AB2C13D15 |
52.57 |
6.6 |
-8.7 |
-0.62 |
0 |
|
|
197025 |
78910560 |
1 |
NC19H25 |
AB19C25 |
15.45 |
1.75 |
-8.99 |
0.43 |
0 |
|
|
197026 |
78910561 |
1 |
BrNC16H18 |
ABC16D18 |
33.07 |
1.98 |
-8.79 |
-0.24 |
0 |
|
|
197027 |
78910562 |
1 |
NC18H23 |
AB18C23 |
16.78 |
2.26 |
-8.86 |
0.48 |
0 |
|
|
197028 |
78910685 |
1 |
ClSN2O5C11H11 |
ABC2D5E11F11 |
-118.72 |
4.39 |
-10.76 |
-1.74 |
0 |
|
|
197029 |
78910754 |
1 |
NCl2S2O3C9H9 |
AB2C2D3E9F9 |
-112.88 |
2.35 |
-9.78 |
-1.31 |
0 |
|
|
197030 |
78910755 |
1 |
ClFNSO3C12H13 |
ABCDE3F12G13 |
-171.35 |
3.22 |
-9.96 |
-0.41 |
0 |
|
|
197031 |
78910756 |
1 |
ClNSO3C13H16 |
ABCD3E13F16 |
-133.74 |
7.9 |
-9.71 |
-0.71 |
0 |
|
|
197032 |
78910757 |
1 |
ClNSO4C13H16 |
ABCD4E13F16 |
-161.21 |
0.78 |
-9.04 |
-0.1 |
0 |
|
|
197033 |
78910882 |
1 |
BrSO2N3C12H18 |
ABC2D3E12F18 |
-41.67 |
5.05 |
-8.31 |
-0.93 |
0 |
|
|
197034 |
78911006 |
1 |
FNOSH8C12 |
ABCDE8F12 |
2.12 |
4.26 |
-9.25 |
-1.33 |
0 |
|
|
197035 |
78911120 |
1 |
N3O3C11H23 |
A3B3C11D23 |
-148.86 |
3.26 |
-9.39 |
0.51 |
0 |
|
|
197036 |
78911650 |
1 |
NO2C15H23 |
AB2C15D23 |
-100.92 |
2.59 |
-8.76 |
0.29 |
0 |
|
|
197037 |
78911926 |
1 |
OSBr2N3C13H19 |
ABC2D3E13F19 |
-5.18 |
4.0 |
-8.43 |
-1.26 |
0 |
|
|
197038 |
78912075 |
1 |
SO4C14H20 |
AB4C14D20 |
-156.52 |
3.31 |
-8.65 |
-0.36 |
0 |
|
|
197039 |
78912580 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-97.21 |
2.52 |
-8.18 |
0.12 |
0 |
|
|
197040 |
78912581 |
2 |
ON2C7H11 |
AB2C7D11 |
-51.7 |
4.42 |
-8.83 |
-0.17 |
0 |
|
|
197041 |
78912582 |
1 |
SN2O4C12H18 |
AB2C4D12E18 |
-142.98 |
6.93 |
-9.23 |
-0.5 |
0 |
|
|
197042 |
78912583 |
1 |
ClO2N3C10H14 |
AB2C3D10E14 |
-52.78 |
7.05 |
-9.04 |
-0.45 |
0 |
|
|
197043 |
78912584 |
2 |
NOC7H11 |
ABC7D11 |
-80.59 |
4.18 |
-9.15 |
0.32 |
0 |
|
|
197044 |
78912585 |
2 |
NOC6H12 |
ABC6D12 |
-104.66 |
1.52 |
-9.19 |
1.14 |
0 |