List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
8081 |
74900 |
2 |
O2C5H8 |
A2B5C8 |
-178.66 |
2.51 |
-10.38 |
0.45 |
0 |
|
|
8082 |
74901 |
2 |
OC5H10 |
AB5C10 |
-135.04 |
1.99 |
-10.64 |
0.9 |
0 |
|
|
8083 |
74902 |
2 |
NOH5C6 |
ABC5D6 |
13.43 |
0.12 |
-8.68 |
-0.92 |
0 |
|
|
8084 |
74904 |
2 |
OC5H7 |
AB5C7 |
-66.06 |
2.87 |
-8.25 |
0.33 |
0 |
|
|
8085 |
74908 |
2 |
ClH3C5 |
AB3C5 |
20.38 |
1.44 |
-9.2 |
-1.01 |
0 |
|
|
8086 |
74918 |
1 |
O3C12H22 |
A3B12C22 |
-175.96 |
4.59 |
-10.75 |
0.15 |
0 |
|
|
8087 |
74928 |
1 |
C11H14 |
A11B14 |
18.77 |
0.67 |
-8.91 |
0.11 |
0 |
|
|
8088 |
74930 |
1 |
Cl2N2C17H20 |
A2B2C17D20 |
25.63 |
0.86 |
-9.22 |
-0.06 |
0 |
|
|
8089 |
74933 |
1 |
NC14H19 |
AB14C19 |
31.03 |
3.13 |
-9.59 |
0.03 |
0 |
|
|
8090 |
74935 |
1 |
NC10H13 |
AB10C13 |
27.12 |
1.94 |
-9.55 |
-0.02 |
0 |
|
|
8091 |
74936 |
1 |
NC22H23 |
AB22C23 |
58.12 |
2.69 |
-9.38 |
-0.13 |
0 |
|
|
8092 |
74941 |
1 |
ClNSF3C19H19 |
ABCD3E19F19 |
-142.85 |
1.74 |
-8.64 |
-0.81 |
0 |
|
|
8093 |
74946 |
2 |
ClNC5H7 |
ABC5D7 |
-3.85 |
3.19 |
-8.36 |
0.01 |
0 |
|
|
8094 |
74950 |
1 |
SN2O2F3H7C13 |
AB2C2D3E7F13 |
-93.32 |
3.93 |
-8.6 |
-2.06 |
0 |
|
|
8095 |
74953 |
1 |
O3H10C11 |
A3B10C11 |
-80.59 |
1.88 |
-9.32 |
-0.88 |
0 |
|
|
8096 |
74954 |
1 |
Cl2C9H10 |
A2B9C10 |
-12.04 |
3.37 |
-9.34 |
-0.29 |
0 |
|
|
8097 |
74959 |
1 |
O3C10H18 |
A3B10C18 |
-167.05 |
4.44 |
-10.75 |
0.16 |
0 |
|
|
8099 |
74974 |
4 |
OH2C3 |
AB2C3 |
-123.4 |
4.72 |
-10.01 |
-1.7 |
0 |
|
|
8100 |
74976 |
2 |
O2C3H6 |
A2B3C6 |
-185.8 |
0.81 |
-10.07 |
0.58 |
0 |
|
|
8101 |
74981 |
1 |
ClSN2C15H15 |
ABC2D15E15 |
39.74 |
4.39 |
-7.79 |
-0.37 |
0 |
|
|
8102 |
74990 |
1 |
ClN4O6C33H39 |
AB4C6D33E39 |
-243.84 |
12.52 |
-9.03 |
-1.5 |
0 |
|
|
8103 |
75016 |
1 |
ClFNO2H3C6 |
ABCD2E3F6 |
-32.38 |
5.31 |
-10.36 |
-1.8 |
0 |
|
|
8104 |
75017 |
1 |
ClFNO2H3C6 |
ABCD2E3F6 |
-34.49 |
3.96 |
-10.59 |
-1.72 |
0 |
|
|
8105 |
75018 |
1 |
O3C11H12 |
A3B11C12 |
-91.46 |
4.02 |
-8.49 |
-0.45 |
0 |
|
|
8106 |
75019 |
1 |
O4C11H14 |
A4B11C14 |
-148.57 |
6.39 |
-8.55 |
-0.01 |
0 |
|
|
8107 |
75020 |
1 |
NO3C6H11 |
AB3C6D11 |
-58.41 |
3.77 |
-11.21 |
-0.78 |
0 |
|
|
8108 |
75021 |
1 |
OI3H5C7 |
AB3C5D7 |
19.25 |
2.27 |
-9.21 |
-1.46 |
0 |
|
|
8109 |
75023 |
1 |
ClON2C15H15 |
ABC2D15E15 |
6.38 |
2.46 |
-8.59 |
-0.41 |
0 |
|
|
8110 |
75024 |
1 |
O3C5H10 |
A3B5C10 |
-144.69 |
3.79 |
-10.69 |
0.72 |
0 |
|
|
8111 |
75025 |
1 |
IH9C12 |
AB9C12 |
63.66 |
1.41 |
-9.35 |
-0.79 |
0 |
|
|
8112 |
75026 |
1 |
NO2C7H15 |
AB2C7D15 |
-119.81 |
2.08 |
-10.66 |
0.84 |
0 |
|
|
8113 |
75029 |
1 |
Si2C7H20 |
A2B7C20 |
-87.79 |
0.28 |
-9.19 |
1.9 |
0 |
|
|
8114 |
75030 |
1 |
ClGeC12H27 |
ABC12D27 |
-98.98 |
3.43 |
-9.86 |
-0.01 |
0 |
|
|
8115 |
75031 |
2 |
SnC4H9 |
AB4C9 |
62.01 |
0.01 |
-9.93 |
1.14 |
0 |
|
|
8116 |
75032 |
1 |
PbCl2H10C12 |
AB2C10D12 |
31.49 |
5.83 |
-10.07 |
-2.12 |
0 |
|
|
8117 |
75033 |
2 |
OC4H4 |
AB4C4 |
-41.12 |
2.26 |
-9.19 |
-0.06 |
0 |
|
|
8118 |
75035 |
1 |
OC37H74 |
AB37C74 |
-210.44 |
3.4 |
-9.9 |
0.74 |
0 |
|
|
8119 |
75036 |
1 |
ON2C18H24 |
AB2C18D24 |
6.86 |
2.42 |
-7.93 |
0.51 |
0 |
|
|
8120 |
75038 |
2 |
OC23H32 |
AB23C32 |
-67.98 |
1.9 |
-8.88 |
-1.58 |
0 |
|
|
8121 |
75039 |
3 |
CSH2O2 |
ABC2D2 |
-230.18 |
4.15 |
-11.9 |
-0.38 |
0 |
|
|
8122 |
75040 |
1 |
OH14C19 |
AB14C19 |
41.41 |
3.64 |
-9.44 |
-0.78 |
0 |
|
|
8123 |
75044 |
1 |
SN2O2H4C7 |
AB2C2D4E7 |
58.98 |
2.89 |
-9.54 |
-2.04 |
0 |
|
|
8124 |
75045 |
1 |
NOSH5C8 |
ABCD5E8 |
36.31 |
2.32 |
-9.21 |
-1.54 |
0 |
|
|
8125 |
75046 |
1 |
NSO2H5C8 |
ABC2D5E8 |
-17.12 |
5.13 |
-9.26 |
-1.46 |
0 |
|
|
8126 |
75048 |
2 |
ClOH7C8 |
ABC7D8 |
-33.92 |
2.1 |
-8.8 |
0.08 |
0 |
|
|
8128 |
75070 |
1 |
ON3C12H13 |
AB3C12D13 |
0.54 |
4.1 |
-8.7 |
-0.36 |
0 |
|
|
8129 |
75071 |
1 |
ClNO2H6C7 |
ABC2D6E7 |
-72.49 |
6.06 |
-9.39 |
-0.82 |
0 |
|
|
8130 |
75078 |
1 |
ON2C14H14 |
AB2C14D14 |
46.03 |
6.3 |
-8.24 |
-1.54 |
0 |
|
|
8131 |
75079 |
1 |
NO3C9H15 |
AB3C9D15 |
-108.74 |
4.73 |
-9.88 |
-0.23 |
0 |
|
|
8132 |
75080 |
1 |
O4C13H22 |
A4B13C22 |
-196.7 |
2.3 |
-10.73 |
-0.38 |
0 |
|
|
8133 |
75081 |
1 |
SbC12H27 |
AB12C27 |
-27.77 |
0.62 |
-8.75 |
2.38 |
0 |
|
|
8134 |
75082 |
1 |
NC5H11 |
AB5C11 |
12.77 |
1.64 |
-8.78 |
1.23 |
0 |
|
|
8135 |
75083 |
1 |
PH13C14 |
AB13C14 |
59.56 |
1.49 |
-8.51 |
0.17 |
0 |
|
|
8136 |
75084 |
1 |
O2C15H28 |
A2B15C28 |
-126.43 |
1.36 |
-10.78 |
-0.29 |
0 |
|
|
8137 |
75085 |
2 |
ClO2C3H4 |
AB2C3D4 |
-195.38 |
0.45 |
-11.78 |
-0.91 |
0 |
|
|
8138 |
75086 |
1 |
ClO4H5C8 |
AB4C5D8 |
-146.57 |
3.15 |
-10.67 |
-1.72 |
0 |
|
|
8139 |
75093 |
1 |
NCl2O2C11H13 |
AB2C2D11E13 |
-67.08 |
2.24 |
-9.21 |
-1.71 |
0 |
|
|
8140 |
75097 |
2 |
O2C5H5 |
A2B5C5 |
-162.06 |
2.23 |
-9.87 |
-0.92 |
0 |
|
|
8141 |
75148 |
1 |
NC13H15 |
AB13C15 |
33.65 |
3.88 |
-9.68 |
0.09 |
0 |
|
|
8142 |
75150 |
1 |
S2O4N5H25C27 |
A2B4C5D25E27 |
-19.12 |
13.85 |
-8.54 |
-1.72 |
0 |
|
|
8144 |
75154 |
1 |
O2Cl4H6C7 |
A2B4C6D7 |
-69.39 |
2.1 |
-9.38 |
-1.28 |
0 |
|
|
8145 |
75158 |
1 |
NO2C11H15 |
AB2C11D15 |
-62.3 |
1.68 |
-8.87 |
-0.6 |
0 |
|
|
8146 |
75162 |
1 |
O2N4C5H6 |
A2B4C5D6 |
1.49 |
11.3 |
-9.11 |
-1.1 |
0 |
|
|
8147 |
75163 |
1 |
BrO2C5H11 |
AB2C5D11 |
-112.96 |
2.53 |
-10.39 |
-0.29 |
0 |
|
|
8148 |
75164 |
1 |
ClN2C10H15 |
AB2C10D15 |
-4.33 |
3.48 |
-8.13 |
0.56 |
0 |
|
|
8149 |
75165 |
1 |
O3H14C18 |
A3B14C18 |
-61.56 |
2.96 |
-8.5 |
-0.71 |
0 |
|
|
8150 |
75166 |
1 |
O4H18C25 |
A4B18C25 |
-67.73 |
2.32 |
-8.55 |
-0.9 |
0 |
|
|
8151 |
75168 |
4 |
ClC2H4 |
AB2C4 |
-98.39 |
1.6 |
-10.77 |
-0.01 |
0 |
|
|
8152 |
75169 |
2 |
ClC2H4 |
AB2C4 |
-45.5 |
3.89 |
-10.64 |
0.5 |
0 |
|
|
8153 |
75171 |
1 |
ON2C7H18 |
AB2C7D18 |
-50.11 |
2.38 |
-8.77 |
2.29 |
0 |
|
|
8154 |
75173 |
1 |
O2C11H16 |
A2B11C16 |
-95.14 |
2.35 |
-8.47 |
0.26 |
0 |
|
|
8155 |
75175 |
1 |
O2C15H24 |
A2B15C24 |
-114.88 |
3.22 |
-8.51 |
0.28 |
0 |
|
|
8156 |
75177 |
2 |
ClHNO2C3 |
ABCD2E3 |
8.77 |
3.21 |
-10.61 |
-2.4 |
0 |
|
|
8157 |
75179 |
1 |
N3C6H13 |
A3B6C13 |
35.62 |
2.95 |
-9.08 |
1.12 |
0 |
|
|
8158 |
75181 |
1 |
ON2H12C14 |
AB2C12D14 |
36.75 |
4.43 |
-8.87 |
-0.62 |
0 |