List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
305991 |
124999916 |
1 |
SN4O4C11H18 |
AB4C4D11E18 |
-130.57 |
8.03 |
-9.59 |
-0.84 |
0 |
|
|
305992 |
124999928 |
1 |
SO2N4C25H26 |
AB2C4D25E26 |
7.01 |
3.75 |
-8.48 |
-1.07 |
0 |
|
|
305993 |
124999952 |
1 |
ClO3N4C24H29 |
AB3C4D24E29 |
-86.42 |
5.49 |
-9.45 |
-0.94 |
0 |
|
|
305994 |
124999958 |
1 |
ClFO2N7C25H29 |
ABC2D7E25F29 |
-57.89 |
6.46 |
-8.52 |
-0.66 |
0 |
|
|
305995 |
124999963 |
1 |
O4N5C13H15 |
A4B5C13D15 |
-110.0 |
2.8 |
-9.13 |
-0.85 |
0 |
|
|
305996 |
124999966 |
1 |
O2N5C26H31 |
A2B5C26D31 |
5.78 |
4.74 |
-8.43 |
-0.63 |
0 |
|
|
305997 |
124999985 |
1 |
N5C16H23 |
A5B16C23 |
46.4 |
2.67 |
-9.15 |
-0.71 |
0 |
|
|
305998 |
124999986 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-57.45 |
3.31 |
-9.8 |
-0.59 |
0 |
|
|
305999 |
125000022 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-18.31 |
4.48 |
-9.41 |
-1.1 |
0 |
|
|
306000 |
125000045 |
1 |
ON4C20H22 |
AB4C20D22 |
28.39 |
5.59 |
-9.21 |
-1.13 |
0 |
|
|
306001 |
125000047 |
1 |
O2N6C17H18 |
A2B6C17D18 |
23.01 |
5.31 |
-9.13 |
-0.69 |
0 |
|
|
306002 |
125000057 |
1 |
O2N5C15H21 |
A2B5C15D21 |
-22.93 |
5.11 |
-8.89 |
0.53 |
0 |
|
|
306003 |
125000058 |
1 |
O2N5C15H21 |
A2B5C15D21 |
-21.96 |
5.05 |
-8.92 |
0.09 |
0 |
|
|
306004 |
125000061 |
1 |
OSN2C18H22 |
ABC2D18E22 |
-11.57 |
4.01 |
-9.04 |
-0.16 |
0 |
|
|
306005 |
125000075 |
1 |
FO2N5C16H20 |
AB2C5D16E20 |
-77.63 |
2.48 |
-8.74 |
-0.32 |
0 |
|
|
306006 |
125000076 |
1 |
FO2N5C16H20 |
AB2C5D16E20 |
-78.43 |
1.59 |
-9.03 |
-0.53 |
0 |
|
|
306007 |
125000085 |
1 |
SO3N5C13H17 |
AB3C5D13E17 |
-43.19 |
5.99 |
-9.79 |
-0.71 |
0 |
|
|
306008 |
125000091 |
1 |
O2N5C17H21 |
A2B5C17D21 |
1.57 |
2.38 |
-8.64 |
-1.01 |
0 |
|
|
306010 |
125000105 |
2 |
NOC15H17 |
ABC15D17 |
-26.38 |
3.1 |
-8.92 |
-0.19 |
0 |
|
|
306011 |
125000122 |
1 |
ON5C16H21 |
AB5C16D21 |
14.98 |
5.57 |
-9.14 |
-0.68 |
0 |
|
|
306012 |
125000123 |
1 |
ON5C16H21 |
AB5C16D21 |
15.75 |
6.74 |
-9.13 |
-0.7 |
0 |
|
|
306014 |
125000248 |
2 |
ON2C8H11 |
AB2C8D11 |
-15.21 |
3.49 |
-8.47 |
-0.2 |
0 |
|
|
306015 |
125000256 |
1 |
ON5C20H29 |
AB5C20D29 |
-2.21 |
5.01 |
-8.51 |
0.2 |
0 |
|
|
306016 |
125000450 |
1 |
ON5C16H21 |
AB5C16D21 |
20.43 |
1.53 |
-9.28 |
-0.59 |
0 |
|
|
306017 |
125000488 |
1 |
SN3O4C16H19 |
AB3C4D16E19 |
-115.32 |
8.94 |
-9.32 |
-0.38 |
0 |
|
|
306018 |
125000499 |
1 |
O3N5C16H17 |
A3B5C16D17 |
-3.33 |
5.12 |
-9.41 |
-0.9 |
0 |
|
|
306019 |
125000507 |
1 |
O2N5C16H19 |
A2B5C16D19 |
2.31 |
5.36 |
-9.62 |
-1.09 |
0 |
|
|
306020 |
125000537 |
1 |
N5C16H21 |
A5B16C21 |
61.09 |
1.78 |
-8.68 |
-0.7 |
0 |
|
|
306021 |
125000597 |
1 |
OSN3C17H21 |
ABC3D17E21 |
-1.09 |
4.84 |
-8.54 |
-0.48 |
0 |
|
|
306022 |
125000612 |
2 |
ON2C8H11 |
AB2C8D11 |
-30.21 |
5.23 |
-9.3 |
-1.02 |
0 |
|
|
306023 |
125000627 |
1 |
ON5C14H21 |
AB5C14D21 |
27.55 |
6.22 |
-8.95 |
0.57 |
0 |
|
|
306024 |
125000697 |
1 |
N5O6C18H23 |
A5B6C18D23 |
-259.42 |
6.25 |
-9.66 |
-0.48 |
0 |
|
|
306025 |
125000717 |
1 |
ON6C19H26 |
AB6C19D26 |
-2.51 |
4.94 |
-8.94 |
-0.43 |
0 |
|
|
306026 |
125000721 |
1 |
SN2O3C13H18 |
AB2C3D13E18 |
-104.09 |
6.07 |
-9.26 |
-0.59 |
0 |
|
|
306027 |
125000725 |
1 |
FON5H24C27 |
ABC5D24E27 |
32.4 |
4.4 |
-9.26 |
-1.38 |
0 |
|
|
306028 |
125000764 |
1 |
O3N4C24H26 |
A3B4C24D26 |
-54.65 |
4.27 |
-8.68 |
-0.53 |
0 |
|
|
306029 |
125000766 |
1 |
FSO2N4C21H21 |
ABC2D4E21F21 |
-75.84 |
2.26 |
-8.39 |
-1.16 |
0 |
|
|
306030 |
125000768 |
1 |
ON6C15H22 |
AB6C15D22 |
24.62 |
4.23 |
-8.65 |
0.0 |
0 |
|
|
306031 |
125000775 |
1 |
ON5C22H27 |
AB5C22D27 |
32.02 |
2.89 |
-8.41 |
-0.51 |
0 |
|
|
306032 |
125000776 |
1 |
ON6C19H24 |
AB6C19D24 |
48.76 |
4.36 |
-8.96 |
-0.54 |
0 |
|
|
306033 |
125000778 |
1 |
ClO2N5C13H16 |
AB2C5D13E16 |
-21.98 |
5.35 |
-9.3 |
0.03 |
0 |
|
|
306034 |
125000782 |
2 |
ON2C13H15 |
AB2C13D15 |
-23.95 |
3.41 |
-9.01 |
-0.52 |
0 |
|
|
306035 |
125000783 |
2 |
ON2C13H15 |
AB2C13D15 |
-21.67 |
2.26 |
-9.19 |
-0.45 |
0 |
|
|
306036 |
125000790 |
1 |
SO2N5C14H19 |
AB2C5D14E19 |
-7.18 |
6.16 |
-9.37 |
-1.09 |
0 |
|
|
306037 |
125000803 |
1 |
FSO2N3C15H18 |
ABC2D3E15F18 |
-74.18 |
4.15 |
-9.52 |
-1.02 |
0 |
|
|
306039 |
125000864 |
1 |
O2F3N5C25H26 |
A2B3C5D25E26 |
-185.44 |
11.01 |
-9.42 |
-0.41 |
0 |
|
|
306040 |
125000866 |
1 |
SN2O4C26H28 |
AB2C4D26E28 |
-94.72 |
3.97 |
-8.7 |
-0.23 |
0 |
|
|
306041 |
125000867 |
1 |
SN2O4C26H28 |
AB2C4D26E28 |
-91.61 |
4.2 |
-8.9 |
-0.22 |
0 |
|
|
306042 |
125000870 |
1 |
O2N5C15H17 |
A2B5C15D17 |
0.85 |
5.01 |
-9.08 |
-1.1 |
0 |
|
|
306043 |
125000875 |
1 |
ON4C10H14 |
AB4C10D14 |
1.96 |
1.86 |
-9.14 |
-0.74 |
0 |