List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
236994 |
92716670 |
1 |
NO4C23H29 |
AB4C23D29 |
-165.91 |
5.4 |
-8.99 |
-1.15 |
0 |
|
|
236995 |
92716671 |
1 |
NO4C23H29 |
AB4C23D29 |
-166.26 |
5.42 |
-9.0 |
-1.16 |
0 |
|
|
236996 |
92716673 |
1 |
NO4C24H31 |
AB4C24D31 |
-171.31 |
5.21 |
-8.99 |
-1.15 |
0 |
|
|
236997 |
92716687 |
1 |
NOC13H19 |
ABC13D19 |
-44.01 |
1.74 |
-8.04 |
0.45 |
0 |
|
|
236998 |
92716688 |
1 |
NOC13H19 |
ABC13D19 |
-45.22 |
2.31 |
-8.28 |
0.43 |
0 |
|
|
236999 |
92716695 |
1 |
ClNS2O3C18H18 |
ABC2D3E18F18 |
-94.53 |
8.64 |
-9.43 |
-1.58 |
0 |
|
|
237000 |
92716713 |
1 |
ClNS2O3C19H20 |
ABC2D3E19F20 |
-107.19 |
8.13 |
-9.53 |
-1.76 |
0 |
|
|
237001 |
92716729 |
1 |
ClFN2O2S2C20H20 |
ABC2D2E2F20G20 |
-87.79 |
4.39 |
-9.22 |
-0.65 |
0 |
|
|
237002 |
92716736 |
2 |
NOSC8H11 |
ABCD8E11 |
-55.32 |
6.46 |
-8.88 |
-0.59 |
0 |
|
|
237003 |
92716740 |
1 |
ClFN2S2O3H18C19 |
ABC2D2E3F18G19 |
-90.5 |
7.58 |
-8.59 |
-0.78 |
0 |
|
|
237004 |
92716741 |
1 |
ClFN2S2O3H18C19 |
ABC2D2E3F18G19 |
-107.05 |
7.0 |
-9.04 |
-0.69 |
0 |
|
|
237005 |
92716748 |
1 |
S2N3O5C19H25 |
A2B3C5D19E25 |
-173.08 |
6.51 |
-8.68 |
-0.77 |
0 |
|
|
237006 |
92716749 |
1 |
NO6H25C27 |
AB6C25D27 |
-134.97 |
1.3 |
-8.47 |
-0.71 |
0 |
|
|
237007 |
92716755 |
1 |
N2S2O3C14H18 |
A2B2C3D14E18 |
-84.26 |
6.64 |
-9.04 |
-0.6 |
0 |
|
|
237008 |
92716756 |
1 |
N2S2O3C21H24 |
A2B2C3D21E24 |
-68.99 |
6.0 |
-9.03 |
-0.45 |
0 |
|
|
237009 |
92716762 |
1 |
N2S2O3C22H26 |
A2B2C3D22E26 |
-62.18 |
5.93 |
-8.57 |
-0.52 |
0 |
|
|
237010 |
92716782 |
2 |
NOSC10H11 |
ABCD10E11 |
-29.18 |
4.65 |
-8.91 |
-0.53 |
0 |
|
|
237011 |
92716831 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-40.56 |
4.0 |
-8.63 |
-0.14 |
0 |
|
|
237012 |
92716837 |
1 |
ClON3H22C25 |
ABC3D22E25 |
35.57 |
7.45 |
-8.87 |
-0.46 |
0 |
|
|
237013 |
92716878 |
1 |
N3O3C27H35 |
A3B3C27D35 |
-87.26 |
8.18 |
-8.08 |
-0.47 |
0 |
|
|
237014 |
92716889 |
1 |
ClNO5H20C26 |
ABC5D20E26 |
-116.22 |
6.53 |
-9.48 |
-2.11 |
0 |
|
|
237015 |
92716908 |
1 |
ClSN2O5C24H31 |
ABC2D5E24F31 |
-200.6 |
7.18 |
-9.44 |
-1.52 |
0 |
|
|
237016 |
92716916 |
1 |
ClSN2O5C23H29 |
ABC2D5E23F29 |
-185.53 |
6.97 |
-9.73 |
-1.49 |
0 |
|
|
237017 |
92716919 |
1 |
NO5C27H27 |
AB5C27D27 |
-141.73 |
5.84 |
-8.56 |
-0.76 |
0 |
|
|
237018 |
92716920 |
1 |
NO5C27H27 |
AB5C27D27 |
-138.38 |
5.06 |
-8.5 |
-0.75 |
0 |
|
|
237019 |
92716922 |
1 |
SN2O5C24H30 |
AB2C5D24E30 |
-182.7 |
5.21 |
-9.47 |
-1.18 |
0 |
|
|
237020 |
92716924 |
1 |
OSN3C19H19 |
ABC3D19E19 |
9.07 |
8.14 |
-8.34 |
-0.9 |
0 |
|
|
237021 |
92716925 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
-31.7 |
8.12 |
-8.23 |
-0.99 |
0 |
|
|
237022 |
92716926 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
-31.58 |
8.3 |
-8.17 |
-0.97 |
0 |
|
|
237023 |
92716929 |
1 |
SN3O3C21H23 |
AB3C3D21E23 |
-64.61 |
9.14 |
-8.12 |
-0.99 |
0 |
|
|
237024 |
92716931 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
-29.65 |
8.1 |
-8.13 |
-0.92 |
0 |
|
|
237025 |
92716935 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-27.6 |
8.54 |
-8.28 |
-1.01 |
0 |
|
|
237026 |
92716940 |
1 |
SO2N3H21C24 |
AB2C3D21E24 |
14.04 |
8.63 |
-8.17 |
-1.03 |
0 |
|
|
237027 |
92716941 |
1 |
SN3O4C23H25 |
AB3C4D23E25 |
-116.59 |
7.6 |
-8.43 |
-1.2 |
0 |
|
|
237028 |
92716943 |
1 |
BrO2N3H16C19 |
AB2C3D16E19 |
-18.25 |
2.99 |
-9.07 |
-0.79 |
0 |
|
|
237029 |
92716947 |
1 |
ClSN2O6C23H27 |
ABC2D6E23F27 |
-215.47 |
5.46 |
-8.95 |
-1.5 |
0 |
|
|
237030 |
92716950 |
1 |
NO2C22H29 |
AB2C22D29 |
-59.64 |
1.95 |
-8.69 |
0.3 |
0 |
|
|
237031 |
92716951 |
1 |
NO2C22H29 |
AB2C22D29 |
-59.34 |
2.33 |
-8.73 |
0.36 |
0 |
|
|
237032 |
92716964 |
1 |
NO2C25H35 |
AB2C25D35 |
-78.38 |
0.84 |
-8.83 |
0.51 |
0 |
|
|
237033 |
92716989 |
1 |
NO3C21H27 |
AB3C21D27 |
-94.7 |
1.95 |
-8.8 |
0.08 |
0 |
|
|
237034 |
92717030 |
1 |
FNO2C26H28 |
ABC2D26E28 |
-70.08 |
0.89 |
-8.88 |
-0.26 |
0 |
|
|
237035 |
92717031 |
1 |
SO2N3C19H21 |
AB2C3D19E21 |
-25.77 |
5.01 |
-8.62 |
-0.45 |
0 |
|
|
237036 |
92717041 |
1 |
FNO3C21H24 |
ABC3D21E24 |
-156.86 |
2.2 |
-9.6 |
-0.31 |
0 |
|
|
237037 |
92717043 |
1 |
FNO3C21H24 |
ABC3D21E24 |
-155.44 |
4.27 |
-9.62 |
-0.33 |
0 |
|
|
237038 |
92717044 |
1 |
ClFNO3H19C23 |
ABCD3E19F23 |
-115.39 |
4.19 |
-9.63 |
-0.5 |
0 |
|
|
237039 |
92717046 |
2 |
NO3H10C12 |
AB3C10D12 |
-89.53 |
5.81 |
-8.97 |
-1.8 |
0 |
|
|
237040 |
92717049 |
1 |
ClN2O5H19C23 |
AB2C5D19E23 |
-72.05 |
3.89 |
-9.53 |
-2.1 |
0 |
|
|
237041 |
92717050 |
1 |
ClN2O5H19C23 |
AB2C5D19E23 |
-71.99 |
3.62 |
-9.57 |
-2.04 |
0 |
|
|
237042 |
92717054 |
1 |
ClNSO3H16C20 |
ABCD3E16F20 |
-54.51 |
3.04 |
-9.54 |
-1.3 |
0 |
|
|
237043 |
92717056 |
1 |
O2S2N4C13H16 |
A2B2C4D13E16 |
-10.16 |
5.19 |
-8.73 |
-1.15 |
0 |
|
|
237044 |
92717057 |
1 |
ClOS2N4H15C17 |
ABC2D4E15F17 |
57.28 |
1.47 |
-8.76 |
-1.0 |
0 |
|
|
237045 |
92717058 |
1 |
ClOS2N4H15C17 |
ABC2D4E15F17 |
55.86 |
3.7 |
-8.87 |
-1.11 |
0 |
|
|
237046 |
92717059 |
1 |
N2O5H22C24 |
A2B5C22D24 |
-116.04 |
4.48 |
-8.6 |
-0.98 |
0 |
|
|
237047 |
92717060 |
1 |
N2O5H22C24 |
A2B5C22D24 |
-111.51 |
1.75 |
-8.67 |
-0.8 |
0 |
|
|
237048 |
92717063 |
1 |
N2O2C21H24 |
A2B2C21D24 |
-11.61 |
3.56 |
-9.04 |
-0.34 |
0 |
|
|
237049 |
92717064 |
1 |
N2O2C21H24 |
A2B2C21D24 |
-13.81 |
1.07 |
-8.83 |
-0.38 |
0 |
|
|
237050 |
92717066 |
1 |
N2O3C23H28 |
A2B3C23D28 |
-56.92 |
2.51 |
-8.42 |
-0.19 |
0 |
|
|
237051 |
92717067 |
2 |
NOC10H12 |
ABC10D12 |
-39.3 |
4.27 |
-8.8 |
-0.32 |
0 |
|
|
237052 |
92717073 |
1 |
N2O5C21H24 |
A2B5C21D24 |
-172.75 |
5.2 |
-9.04 |
-0.8 |
0 |
|
|
237053 |
92717074 |
1 |
N3C19H29 |
A3B19C29 |
6.98 |
3.59 |
-8.67 |
0.07 |
0 |
|
|
237054 |
92717081 |
1 |
O3N6H16C18 |
A3B6C16D18 |
-11.39 |
2.55 |
-9.19 |
-1.66 |
0 |
|
|
237055 |
92717095 |
2 |
O2N3H8C11 |
A2B3C8D11 |
-18.47 |
8.94 |
-9.19 |
-2.04 |
0 |
|
|
237056 |
92717103 |
1 |
BrO2N3C20H20 |
AB2C3D20E20 |
-10.92 |
6.2 |
-9.18 |
-0.43 |
0 |
|
|
237057 |
92717105 |
1 |
BrO2N4C23H25 |
AB2C4D23E25 |
-11.93 |
4.67 |
-8.9 |
-0.47 |
0 |
|
|
237058 |
92717111 |
1 |
ClO2N3C20H20 |
AB2C3D20E20 |
-24.08 |
8.84 |
-8.69 |
-0.55 |
0 |
|
|
237059 |
92717112 |
1 |
ClO2N4C23H25 |
AB2C4D23E25 |
-22.1 |
6.94 |
-8.74 |
-0.54 |
0 |
|
|
237060 |
92717115 |
1 |
O2N4C25H30 |
A2B4C25D30 |
-26.6 |
4.99 |
-9.04 |
-0.41 |
0 |
|
|
237061 |
92717116 |
1 |
ON4C24H30 |
AB4C24D30 |
7.17 |
6.78 |
-8.64 |
-0.18 |
0 |
|
|
237062 |
92717117 |
2 |
NO3H10C13 |
AB3C10D13 |
-141.76 |
4.68 |
-8.63 |
-1.52 |
0 |
|
|
237063 |
92717125 |
1 |
N3O3C23H25 |
A3B3C23D25 |
-72.08 |
4.07 |
-9.13 |
-0.44 |
0 |
|
|
237064 |
92717135 |
1 |
FON4C22H25 |
ABC4D22E25 |
-25.2 |
9.42 |
-8.62 |
-0.28 |
0 |
|
|
237065 |
92717136 |
1 |
O3N4C22H26 |
A3B4C22D26 |
-48.71 |
3.23 |
-8.9 |
-0.23 |
0 |
|
|
237066 |
92717141 |
1 |
ClO2N4C24H27 |
AB2C4D24E27 |
-27.78 |
5.89 |
-9.18 |
-0.48 |
0 |
|
|
237067 |
92717144 |
1 |
ClO2N4C24H27 |
AB2C4D24E27 |
-31.11 |
7.36 |
-8.63 |
-0.52 |
0 |
|
|
237068 |
92717147 |
1 |
ClON4C23H27 |
ABC4D23E27 |
14.78 |
10.55 |
-8.32 |
-0.17 |
0 |