List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
404812 |
135071213 |
1 |
SnO2C18H36 |
AB2C18D36 |
-146.45 |
2.35 |
-9.69 |
0.3 |
0 |
|
|
404813 |
135071214 |
1 |
SnO2C18H36 |
AB2C18D36 |
-150.34 |
0.46 |
-9.72 |
0.4 |
0 |
|
|
404814 |
135071215 |
1 |
NF2S2O3C20H25 |
AB2C2D3E20F25 |
-180.36 |
4.85 |
-8.17 |
-0.68 |
0 |
|
|
404815 |
135071216 |
1 |
NO7C21H29 |
AB7C21D29 |
-255.69 |
4.59 |
-8.38 |
-0.15 |
0 |
|
|
404816 |
135071222 |
1 |
O3C14H26 |
A3B14C26 |
-187.76 |
5.32 |
-10.3 |
0.94 |
0 |
|
|
404817 |
135071249 |
1 |
SN3O4C13H17 |
AB3C4D13E17 |
-51.49 |
4.18 |
-10.67 |
-2.1 |
0 |
|
|
404818 |
135071250 |
2 |
OC8H10 |
AB8C10 |
-34.88 |
2.86 |
-9.4 |
0.31 |
0 |
|
|
404819 |
135071251 |
1 |
NOSiC14H29 |
ABCD14E29 |
-102.02 |
4.77 |
-8.66 |
1.0 |
0 |
|
|
404820 |
135071255 |
2 |
O5C6H11 |
A5B6C11 |
-463.47 |
4.69 |
-10.36 |
0.66 |
0 |
|
|
404821 |
135071257 |
1 |
NO3C6H13 |
AB3C6D13 |
-146.6 |
1.41 |
-9.33 |
1.86 |
-1 |
|
|
404822 |
135071258 |
1 |
N2O5C13H17 |
A2B5C13D17 |
-191.68 |
2.4 |
0.0 |
0.0 |
0 |
|
|
404823 |
135071259 |
1 |
N2O5C13H18 |
A2B5C13D18 |
-206.62 |
4.05 |
-9.87 |
-0.31 |
0 |
|
|
404824 |
135071367 |
1 |
OSF3C16H19 |
ABC3D16E19 |
-172.2 |
4.55 |
-9.12 |
-0.49 |
0 |
|
|
404825 |
135071372 |
3 |
OC5H6 |
AB5C6 |
-82.08 |
3.21 |
-9.82 |
-0.89 |
0 |
|
|
404826 |
135071374 |
1 |
NO2C14H23 |
AB2C14D23 |
-63.12 |
3.46 |
-9.3 |
0.1 |
0 |
|
|
404827 |
135071375 |
1 |
NO3C13H15 |
AB3C13D15 |
-46.34 |
3.17 |
-9.0 |
-0.19 |
0 |
|
|
404828 |
135071376 |
1 |
NSO4C28H29 |
ABC4D28E29 |
-43.53 |
3.83 |
-9.11 |
-0.95 |
0 |
|
|
404829 |
135071377 |
1 |
ClNOH14C15 |
ABCD14E15 |
14.0 |
3.3 |
-8.45 |
-0.78 |
0 |
|
|
404830 |
135071378 |
1 |
FNOH22C24 |
ABCD22E24 |
0.34 |
4.63 |
-9.02 |
-0.71 |
0 |
|
|
404831 |
135071379 |
1 |
ClNOH22C24 |
ABCD22E24 |
40.73 |
3.92 |
-8.42 |
-0.48 |
0 |
|
|
404832 |
135071380 |
1 |
BrNO2C19H20 |
ABC2D19E20 |
-42.36 |
2.54 |
-9.06 |
-1.04 |
0 |
|
|
404833 |
135071381 |
1 |
NO5C17H23 |
AB5C17D23 |
-216.09 |
3.61 |
-8.79 |
0.19 |
0 |
|
|
404834 |
135071382 |
1 |
NO2C15H19 |
AB2C15D19 |
-20.97 |
3.99 |
-9.43 |
-0.23 |
0 |
|
|
404835 |
135071383 |
1 |
NO5C20H25 |
AB5C20D25 |
-153.71 |
5.26 |
-9.63 |
-0.14 |
0 |
|
|
404836 |
135071385 |
1 |
BrSiO6C17H27 |
ABC6D17E27 |
-276.04 |
2.99 |
-9.97 |
-0.88 |
0 |
|
|
404837 |
135071386 |
1 |
BrO6C13H19 |
AB6C13D19 |
-248.78 |
2.5 |
-10.28 |
-1.05 |
0 |
|
|
404838 |
135071388 |
1 |
SO4C23H32 |
AB4C23D32 |
-138.79 |
6.42 |
-8.91 |
-0.41 |
0 |
|
|
404839 |
135071390 |
1 |
NSO5C23H29 |
ABC5D23E29 |
-141.71 |
4.1 |
-9.02 |
-1.05 |
0 |
|
|
404840 |
135071391 |
1 |
NSO5C18H27 |
ABC5D18E27 |
-169.57 |
6.11 |
-8.99 |
-0.89 |
0 |
|
|
404841 |
135071392 |
1 |
BrNO3C15H18 |
ABC3D15E18 |
-90.81 |
2.78 |
-9.4 |
-1.22 |
0 |
|
|
404842 |
135071393 |
1 |
NOH25C30 |
ABC25D30 |
75.22 |
4.19 |
-8.55 |
-0.44 |
0 |
|
|
404843 |
135071394 |
1 |
BrO2C19H19 |
AB2C19D19 |
-1.45 |
1.75 |
-8.78 |
-0.13 |
0 |
|
|
404844 |
135071395 |
1 |
SiO5C31H44 |
AB5C31D44 |
-259.03 |
3.67 |
-9.02 |
0.05 |
0 |
|
|
404845 |
135071397 |
1 |
BrO5C21H21 |
AB5C21D21 |
-183.33 |
2.18 |
-9.8 |
-0.56 |
0 |
|
|
404846 |
135071400 |
1 |
O3C17H20 |
A3B17C20 |
-66.46 |
3.45 |
-8.71 |
-0.1 |
0 |
|
|
404847 |
135071402 |
1 |
NSO2C12H23 |
ABC2D12E23 |
-94.14 |
3.45 |
-8.37 |
0.41 |
0 |
|
|
404848 |
135071404 |
1 |
IO2C9H15 |
AB2C9D15 |
-79.02 |
1.65 |
-9.44 |
-1.14 |
0 |
|
|
404849 |
135071405 |
1 |
ON4H10C13 |
AB4C10D13 |
137.5 |
2.69 |
-9.0 |
-1.29 |
0 |
|
|
404850 |
135071406 |
1 |
BrN2H13C14 |
AB2C13D14 |
69.89 |
0.98 |
-8.59 |
-0.36 |
0 |
|
|
404851 |
135071407 |
1 |
NO2C22H25 |
AB2C22D25 |
-4.3 |
4.58 |
-8.58 |
-0.63 |
0 |
|
|
404852 |
135071476 |
1 |
O4N5C12H23 |
A4B5C12D23 |
-103.53 |
3.12 |
-9.66 |
-0.6 |
0 |
|
|
404853 |
135071517 |
1 |
NSO5C21H25 |
ABC5D21E25 |
-123.41 |
5.75 |
-8.95 |
-0.92 |
0 |
|
|
404854 |
135071518 |
1 |
BrNO2H24C27 |
ABC2D24E27 |
56.72 |
3.07 |
-8.63 |
-0.6 |
0 |
|
|
404855 |
135071522 |
1 |
ClN2H17C23 |
AB2C17D23 |
121.01 |
6.86 |
-8.85 |
-0.63 |
0 |
|
|
404856 |
135071523 |
1 |
O4C17H22 |
A4B17C22 |
-160.76 |
3.1 |
-8.81 |
0.16 |
0 |
|
|
404857 |
135071525 |
1 |
O2C15H16 |
A2B15C16 |
2.05 |
4.01 |
-9.77 |
-0.35 |
0 |
|
|
404858 |
135071527 |
1 |
NO7C18H25 |
AB7C18D25 |
-288.64 |
6.08 |
-8.87 |
-0.17 |
0 |
|
|
404859 |
135071528 |
1 |
N2O7C16H20 |
A2B7C16D20 |
-210.41 |
8.22 |
-9.63 |
-1.39 |
0 |
|
|
404860 |
135071529 |
1 |
SO3C14H18 |
AB3C14D18 |
-110.32 |
2.58 |
-8.7 |
-0.08 |
0 |
|
|
404861 |
135071530 |
1 |
O2S2C7H12 |
A2B2C7D12 |
-50.98 |
0.89 |
-8.2 |
-0.1 |
0 |