List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
125936 |
50944510 |
1 |
SO3N5C19H25 |
AB3C5D19E25 |
5.02 |
7.69 |
-8.88 |
-1.24 |
0 |
|
|
125937 |
50944557 |
1 |
O2N5C11H13 |
A2B5C11D13 |
2.56 |
2.55 |
-8.83 |
-0.97 |
0 |
|
|
125938 |
50944596 |
1 |
ON5C18H19 |
AB5C18D19 |
42.44 |
6.74 |
-8.61 |
-0.51 |
0 |
|
|
125939 |
50944615 |
1 |
SO2N4C21H22 |
AB2C4D21E22 |
20.66 |
8.61 |
-8.51 |
-0.84 |
0 |
|
|
125940 |
50944782 |
1 |
ClSN2O3C16H17 |
ABC2D3E16F17 |
-91.08 |
4.41 |
-9.08 |
-0.77 |
0 |
|
|
125941 |
50944811 |
1 |
SN2O4C17H20 |
AB2C4D17E20 |
-122.12 |
2.7 |
-8.55 |
-0.66 |
0 |
|
|
125942 |
50944845 |
1 |
OSN3C14H21 |
ABC3D14E21 |
-32.66 |
4.89 |
-8.6 |
-0.54 |
0 |
|
|
125943 |
50944846 |
1 |
ON7C22H27 |
AB7C22D27 |
36.49 |
4.01 |
-8.73 |
-0.54 |
0 |
|
|
125944 |
50944939 |
1 |
ClSN2O4C12H17 |
ABC2D4E12F17 |
-161.7 |
8.4 |
-9.02 |
-0.4 |
0 |
|
|
125945 |
50944940 |
1 |
SN3O5C17H25 |
AB3C5D17E25 |
-201.82 |
6.37 |
-8.79 |
-0.34 |
0 |
|
|
125946 |
50944947 |
1 |
ClSN3O4C17H24 |
ABC3D4E17F24 |
-180.61 |
5.1 |
-9.16 |
-0.14 |
0 |
|
|
125947 |
50945042 |
2 |
ON3C11H12 |
AB3C11D12 |
43.63 |
5.03 |
-8.59 |
-0.97 |
0 |
|
|
125948 |
50945086 |
1 |
NO5H13C14 |
AB5C13D14 |
-194.47 |
6.54 |
-9.08 |
-0.68 |
0 |
|
|
125949 |
50945145 |
1 |
FON7C18H20 |
ABC7D18E20 |
3.99 |
3.93 |
-9.06 |
-0.64 |
0 |
|
|
125950 |
50945200 |
1 |
N2O6C15H18 |
A2B6C15D18 |
-205.75 |
8.03 |
-8.53 |
-0.94 |
0 |
|
|
125951 |
50945283 |
1 |
SO2N6C19H26 |
AB2C6D19E26 |
-36.76 |
1.84 |
-8.54 |
-0.19 |
0 |
|
|
125952 |
50945297 |
2 |
ON3C5H7 |
AB3C5D7 |
-36.3 |
4.57 |
-8.96 |
-0.56 |
0 |
|
|
125953 |
50945316 |
1 |
N2O2C17H18 |
A2B2C17D18 |
-60.78 |
3.13 |
-8.56 |
-0.39 |
0 |
|
|
125954 |
50945354 |
1 |
ON6C21H26 |
AB6C21D26 |
18.47 |
3.13 |
-8.35 |
0.11 |
0 |
|
|
125955 |
50945537 |
1 |
OSN6C22H26 |
ABC6D22E26 |
24.14 |
2.17 |
-8.41 |
-0.84 |
0 |
|
|
125956 |
50945606 |
1 |
OSN3C15H23 |
ABC3D15E23 |
-29.56 |
5.26 |
-8.39 |
-0.33 |
0 |
|
|
125957 |
50945607 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-66.25 |
2.79 |
-8.62 |
-0.47 |
0 |
|
|
125958 |
50945658 |
1 |
SN3O4C22H29 |
AB3C4D22E29 |
-134.35 |
6.79 |
-8.51 |
-0.83 |
0 |
|
|
125959 |
50945837 |
1 |
OSN3C16H21 |
ABC3D16E21 |
-13.87 |
5.89 |
-8.13 |
-0.31 |
0 |
|
|
125960 |
50945915 |
1 |
ClSO2N6C19H19 |
ABC2D6E19F19 |
36.78 |
2.53 |
-8.82 |
-1.11 |
0 |
|
|
125961 |
50945927 |
2 |
NOC9H10 |
ABC9D10 |
-57.95 |
3.26 |
-8.85 |
-0.44 |
0 |
|
|
125962 |
50945928 |
1 |
O2N6C25H26 |
A2B6C25D26 |
7.09 |
3.34 |
-8.1 |
-0.32 |
0 |
|
|
125963 |
50945929 |
1 |
ClFON6C18H22 |
ABCD6E18F22 |
-48.78 |
5.11 |
-8.8 |
-0.51 |
0 |
|
|
125964 |
50946042 |
1 |
SN3O4C17H25 |
AB3C4D17E25 |
-144.95 |
7.27 |
-8.67 |
-0.92 |
0 |
|
|
125965 |
50946043 |
1 |
O2N6C25H30 |
A2B6C25D30 |
-14.19 |
3.31 |
-8.35 |
-0.09 |
0 |
|
|
125966 |
50946044 |
1 |
SO2N5C18H25 |
AB2C5D18E25 |
-35.74 |
4.17 |
-8.6 |
-0.08 |
0 |
|
|
125967 |
50946098 |
1 |
FON7C19H22 |
ABC7D19E22 |
8.35 |
4.99 |
-8.77 |
-0.99 |
0 |
|
|
125968 |
50946099 |
1 |
SO2N4C17H24 |
AB2C4D17E24 |
-60.93 |
3.38 |
-8.72 |
-0.66 |
0 |
|
|
125969 |
50946100 |
1 |
FON7C21H24 |
ABC7D21E24 |
-3.03 |
4.58 |
-8.95 |
-0.59 |
0 |
|
|
125970 |
50946133 |
1 |
ON6C17H24 |
AB6C17D24 |
-1.84 |
5.91 |
-8.6 |
0.21 |
0 |
|
|
125971 |
50946153 |
1 |
N3O3H13C15 |
A3B3C13D15 |
-65.22 |
6.44 |
-9.21 |
-1.15 |
0 |
|
|
125972 |
50946193 |
1 |
SO2N5C18H25 |
AB2C5D18E25 |
-34.71 |
3.67 |
-8.5 |
-0.06 |
0 |
|
|
125973 |
50946211 |
1 |
OSN7C19H23 |
ABC7D19E23 |
66.29 |
4.34 |
-8.37 |
-0.73 |
0 |
|
|
125974 |
50946391 |
1 |
ClSF2N2O3H13C15 |
ABC2D2E3F13G15 |
-174.21 |
1.84 |
-9.18 |
-0.55 |
0 |
|
|
125975 |
50946392 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-161.63 |
3.74 |
-9.15 |
-0.55 |
0 |
|
|
125976 |
50946393 |
1 |
FON7C19H22 |
ABC7D19E22 |
6.69 |
6.31 |
-8.31 |
-0.48 |
0 |
|
|
125977 |
50946394 |
1 |
SN2O3C15H22 |
AB2C3D15E22 |
-125.8 |
5.41 |
-9.21 |
-0.12 |
0 |
|
|
125978 |
50946395 |
1 |
SN2O3C15H22 |
AB2C3D15E22 |
-122.05 |
0.59 |
-9.54 |
-0.74 |
0 |
|
|
125979 |
50946446 |
1 |
ON2C19H30 |
AB2C19D30 |
-66.93 |
2.44 |
-8.83 |
0.46 |
0 |
|
|
125980 |
50946454 |
1 |
ClON3C20H24 |
ABC3D20E24 |
-9.03 |
4.93 |
-8.36 |
-0.13 |
0 |
|
|
125981 |
50946638 |
1 |
FSO2N6H11C16 |
ABC2D6E11F16 |
42.85 |
10.77 |
-8.83 |
-1.43 |
0 |
|
|
125982 |
50946664 |
1 |
SN2O3C13H20 |
AB2C3D13E20 |
-114.47 |
2.5 |
-9.19 |
0.17 |
0 |
|
|
125983 |
50946665 |
1 |
SN3O4C19H21 |
AB3C4D19E21 |
-131.5 |
4.76 |
-9.14 |
-0.75 |
0 |
|
|
125984 |
50946666 |
2 |
ON3C5H7 |
AB3C5D7 |
-36.29 |
5.01 |
-8.85 |
-0.56 |
0 |
|
|
125985 |
50946714 |
1 |
FON6C18H23 |
ABC6D18E23 |
-45.33 |
2.97 |
-8.77 |
-0.14 |
0 |
|
|
125986 |
50946875 |
1 |
O2S2N4C13H16 |
A2B2C4D13E16 |
6.14 |
3.7 |
-8.47 |
-1.12 |
0 |
|
|
125987 |
50946899 |
1 |
O2N6C21H22 |
A2B6C21D22 |
43.97 |
5.49 |
-8.38 |
-0.8 |
0 |
|
|
125988 |
50947101 |
1 |
FON7C16H16 |
ABC7D16E16 |
37.1 |
3.39 |
-9.02 |
-1.18 |
0 |
|
|
125989 |
50947107 |
1 |
SO2N6C23H28 |
AB2C6D23E28 |
3.0 |
8.32 |
-8.06 |
-0.45 |
0 |
|
|
125990 |
50947188 |
1 |
SN3O4C17H19 |
AB3C4D17E19 |
-129.28 |
6.57 |
-9.09 |
-0.91 |
0 |
|
|
125991 |
50947254 |
1 |
OSN5H13C14 |
ABC5D13E14 |
78.26 |
5.28 |
-9.05 |
-0.98 |
0 |
|
|
125992 |
50947493 |
1 |
SO2N5C22H31 |
AB2C5D22E31 |
-54.53 |
6.53 |
-8.45 |
-0.28 |
0 |
|
|
125993 |
50947568 |
1 |
BrON4C12H13 |
ABC4D12E13 |
50.51 |
4.57 |
-9.0 |
-0.94 |
0 |
|
|
125994 |
50947775 |
1 |
FSO2N6C18H19 |
ABC2D6E18F19 |
-14.64 |
5.48 |
-8.91 |
-1.12 |
0 |
|
|
125995 |
50947803 |
1 |
SN3O3C15H29 |
AB3C3D15E29 |
-156.69 |
3.37 |
-8.7 |
0.41 |
0 |
|
|
125996 |
50947867 |
1 |
OSN5C16H19 |
ABC5D16E19 |
96.72 |
5.95 |
-8.77 |
-1.58 |
0 |
|
|
125997 |
50947868 |
2 |
ON3C8H9 |
AB3C8D9 |
24.02 |
2.77 |
-9.19 |
-0.62 |
0 |
|
|
125998 |
50947869 |
1 |
ON7C21H23 |
AB7C21D23 |
68.74 |
2.19 |
-8.5 |
-0.67 |
0 |
|
|
125999 |
50948074 |
1 |
SN2O3C15H22 |
AB2C3D15E22 |
-116.6 |
6.3 |
-9.31 |
-0.28 |
0 |
|
|
126000 |
50948075 |
1 |
ClSN5C17H20 |
ABC5D17E20 |
89.38 |
2.96 |
-8.41 |
-0.6 |
0 |
|
|
126001 |
50948148 |
1 |
ON4H14C16 |
AB4C14D16 |
55.62 |
5.4 |
-9.11 |
-0.84 |
0 |
|
|
126002 |
50948160 |
1 |
N3C13H17 |
A3B13C17 |
45.36 |
3.57 |
-8.02 |
-0.11 |
0 |
|
|
126003 |
50948161 |
1 |
ON4C16H26 |
AB4C16D26 |
-36.0 |
2.76 |
-8.23 |
0.49 |
0 |
|
|
126004 |
50948166 |
1 |
O3N4C15H20 |
A3B4C15D20 |
-24.52 |
4.56 |
-8.5 |
-0.57 |
0 |
|
|
126005 |
50948167 |
1 |
ON4C22H22 |
AB4C22D22 |
67.24 |
5.51 |
-8.47 |
-0.18 |
0 |
|
|
126006 |
50948168 |
2 |
ON2C10H11 |
AB2C10D11 |
59.4 |
2.91 |
-8.98 |
-0.92 |
0 |
|
|
126007 |
50948169 |
1 |
ON6C21H36 |
AB6C21D36 |
-24.86 |
1.49 |
-8.32 |
-0.3 |
0 |
|
|
126008 |
50948170 |
1 |
O2N3H19C20 |
A2B3C19D20 |
59.72 |
6.05 |
-8.57 |
-1.09 |
0 |
|
|
126009 |
50948171 |
1 |
O2N3H21C23 |
A2B3C21D23 |
28.3 |
1.6 |
-8.68 |
-0.82 |
0 |
|
|
126010 |
50948311 |
1 |
SO2N6C16H22 |
AB2C6D16E22 |
36.43 |
6.52 |
-8.25 |
-0.63 |
0 |
|
|
126011 |
50948353 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-40.41 |
4.99 |
-9.06 |
-0.35 |
0 |
|
|
126012 |
50948415 |
1 |
O2N5C19H21 |
A2B5C19D21 |
28.84 |
5.67 |
-9.42 |
-0.38 |
0 |
|
|
126013 |
50948431 |
1 |
F2O2N3C13H15 |
A2B2C3D13E15 |
-129.92 |
4.19 |
-9.3 |
-0.67 |
0 |
|
|
126014 |
50948477 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-26.29 |
3.98 |
-8.54 |
-0.06 |
0 |
|
|
126015 |
50948494 |
1 |
SN4O4C14H18 |
AB4C4D14E18 |
-92.05 |
6.0 |
-9.34 |
-0.99 |
0 |
|
|
126016 |
50948516 |
1 |
N6C21H28 |
A6B21C28 |
79.39 |
2.63 |
-8.18 |
-0.38 |
0 |
|
|
126017 |
50948558 |
1 |
SO3N5H15C16 |
AB3C5D15E16 |
-43.16 |
4.58 |
-9.49 |
-1.1 |
0 |
|
|
126018 |
50948595 |
1 |
O2N5C17H29 |
A2B5C17D29 |
-49.93 |
3.68 |
-8.7 |
-0.08 |
0 |
|
|
126019 |
50948616 |
1 |
N5C24H27 |
A5B24C27 |
89.18 |
7.24 |
-8.04 |
-0.82 |
0 |
|
|
126020 |
50948675 |
1 |
N3O5C22H23 |
A3B5C22D23 |
-164.6 |
2.31 |
-8.63 |
-0.27 |
0 |
|
|
126021 |
50948704 |
1 |
OSN6C16H20 |
ABC6D16E20 |
42.44 |
3.5 |
-8.86 |
-1.56 |
0 |
|
|
126022 |
50948795 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-150.45 |
4.7 |
-8.98 |
0.31 |
0 |
|
|
126023 |
50948858 |
1 |
ClON4C17H21 |
ABC4D17E21 |
-18.09 |
3.19 |
-8.96 |
-0.75 |
0 |
|
|
126024 |
50948883 |
1 |
ON5C13H19 |
AB5C13D19 |
28.09 |
3.41 |
-9.22 |
-0.44 |
0 |
|
|
126025 |
50948906 |
1 |
FN2O2C18H19 |
AB2C2D18E19 |
-60.56 |
4.87 |
-9.12 |
-0.26 |
0 |
|
|
126026 |
50948923 |
1 |
ON3C20H25 |
AB3C20D25 |
16.79 |
5.98 |
-8.62 |
-0.11 |
0 |
|
|
126027 |
50948924 |
2 |
NO2C10H12 |
AB2C10D12 |
-134.47 |
3.48 |
-9.76 |
-0.14 |
0 |
|
|
126028 |
50949003 |
1 |
ON5C19H33 |
AB5C19D33 |
-29.8 |
5.19 |
-8.14 |
0.26 |
0 |
|
|
126029 |
50949004 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-70.13 |
4.04 |
-9.04 |
0.68 |
0 |
|
|
126030 |
50949005 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
-3.66 |
5.85 |
-8.87 |
-1.07 |
0 |
|
|
126031 |
50949014 |
2 |
NOC9H10 |
ABC9D10 |
-66.39 |
3.2 |
-8.66 |
-0.19 |
0 |
|
|
126032 |
50949049 |
1 |
OSN3C20H23 |
ABC3D20E23 |
30.92 |
5.3 |
-8.64 |
-0.55 |
0 |
|
|
126033 |
50949053 |
1 |
NO5C17H21 |
AB5C17D21 |
-184.64 |
10.31 |
-9.47 |
-0.48 |
0 |
|
|
126034 |
50949077 |
1 |
SO2N4H16C19 |
AB2C4D16E19 |
41.54 |
4.61 |
-8.64 |
-0.99 |
0 |
|
|
126035 |
50949187 |
2 |
NOC10H11 |
ABC10D11 |
-35.67 |
6.35 |
-9.11 |
-0.3 |
0 |