List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
52183 |
12014983 |
2 |
OC14H27 |
AB14C27 |
-212.98 |
2.13 |
-10.65 |
0.96 |
0 |
|
|
52184 |
12014984 |
1 |
NOH13C16 |
ABC13D16 |
21.44 |
3.64 |
-8.83 |
-0.87 |
0 |
|
|
52185 |
12014985 |
1 |
NO2H13C16 |
AB2C13D16 |
14.62 |
4.32 |
-8.68 |
-0.99 |
0 |
|
|
52186 |
12014986 |
1 |
N2O7C40H40 |
A2B7C40D40 |
-84.3 |
10.57 |
-8.56 |
-1.18 |
0 |
|
|
52187 |
12014988 |
1 |
NO5C19H19 |
AB5C19D19 |
-164.29 |
2.57 |
-8.48 |
-1.15 |
0 |
|
|
52188 |
12014989 |
1 |
NO5C20H21 |
AB5C20D21 |
-175.25 |
3.21 |
-8.43 |
-1.03 |
0 |
|
|
52189 |
12014991 |
1 |
NO7C19H19 |
AB7C19D19 |
-246.55 |
5.65 |
-9.06 |
-1.14 |
0 |
|
|
52190 |
12014992 |
1 |
NO4C17H21 |
AB4C17D21 |
-136.79 |
1.04 |
-8.55 |
-0.58 |
0 |
|
|
52191 |
12014993 |
1 |
NO3C15H15 |
AB3C15D15 |
-72.39 |
4.3 |
-9.16 |
-1.05 |
0 |
|
|
52192 |
12014994 |
1 |
NBr2O4C16H17 |
AB2C4D16E17 |
-118.51 |
2.88 |
-9.47 |
-1.41 |
0 |
|
|
52193 |
12014995 |
1 |
NO3H13C14 |
AB3C13D14 |
-75.63 |
3.23 |
-8.8 |
-0.74 |
0 |
|
|
52194 |
12014996 |
1 |
NO3H13C14 |
AB3C13D14 |
-62.15 |
2.91 |
-10.24 |
-1.25 |
0 |
|
|
52195 |
12014997 |
1 |
NO3C12H17 |
AB3C12D17 |
-111.05 |
3.35 |
-9.35 |
0.16 |
0 |
|
|
52196 |
12014998 |
1 |
NOPC25H26 |
ABCD25E26 |
1.77 |
3.79 |
-8.54 |
-0.14 |
0 |
|
|
52197 |
12014999 |
1 |
OSiC17H28 |
ABC17D28 |
-89.6 |
1.47 |
-8.69 |
0.32 |
0 |
|
|
52198 |
12015000 |
1 |
OSiC17H28 |
ABC17D28 |
-85.72 |
1.32 |
-9.13 |
0.4 |
0 |
|
|
52199 |
12015001 |
1 |
OSiC20H34 |
ABC20D34 |
-96.59 |
1.28 |
-8.7 |
0.32 |
0 |
|
|
52200 |
12015002 |
1 |
OC18H20 |
AB18C20 |
11.84 |
1.61 |
-9.15 |
0.15 |
0 |
|
|
52201 |
12015003 |
1 |
OSiC22H38 |
ABC22D38 |
-107.11 |
1.44 |
-8.64 |
0.36 |
0 |
|
|
52202 |
12015004 |
1 |
OSiC18H30 |
ABC18D30 |
-94.19 |
1.45 |
-8.7 |
0.31 |
0 |
|
|
52203 |
12015005 |
1 |
OSiC18H30 |
ABC18D30 |
-90.29 |
1.45 |
-9.06 |
0.31 |
0 |
|
|
52204 |
12015006 |
1 |
OSiC19H32 |
ABC19D32 |
-94.13 |
1.33 |
-9.04 |
0.27 |
0 |
|
|
52205 |
12015007 |
1 |
OSiC21H36 |
ABC21D36 |
-101.3 |
1.31 |
-8.71 |
0.34 |
0 |
|
|
52206 |
12015008 |
1 |
OSiC18H30 |
ABC18D30 |
-91.42 |
1.17 |
-9.07 |
0.37 |
0 |
|
|
52207 |
12015009 |
1 |
OSiC19H32 |
ABC19D32 |
-100.32 |
1.2 |
-8.73 |
0.37 |
0 |
|
|
52208 |
12015010 |
1 |
OSiC22H38 |
ABC22D38 |
-107.1 |
1.55 |
-8.65 |
0.37 |
0 |
|
|
52209 |
12015011 |
1 |
OSiC17H28 |
ABC17D28 |
-85.2 |
1.53 |
-9.02 |
0.26 |
0 |
|
|
52210 |
12015012 |
1 |
OSiC19H32 |
ABC19D32 |
-93.15 |
1.55 |
-9.01 |
0.31 |
0 |
|
|
52211 |
12015013 |
1 |
OSiC16H26 |
ABC16D26 |
-89.39 |
1.31 |
-8.74 |
0.03 |
0 |
|
|
52212 |
12015014 |
1 |
OSiC17H28 |
ABC17D28 |
-92.63 |
1.55 |
-8.72 |
0.0 |
0 |
|
|
52213 |
12015015 |
1 |
OSiC18H30 |
ABC18D30 |
-100.94 |
1.73 |
-8.75 |
0.3 |
0 |
|
|
52214 |
12015018 |
1 |
ON2H10C18 |
AB2C10D18 |
52.3 |
2.92 |
-8.49 |
-1.23 |
0 |
|
|
52215 |
12015019 |
1 |
ON3H15C16 |
AB3C15D16 |
47.57 |
6.04 |
-9.25 |
-0.47 |
0 |
|
|
52216 |
12015020 |
1 |
BrON3H14C16 |
ABC3D14E16 |
50.32 |
6.71 |
-9.33 |
-0.81 |
0 |
|
|
52217 |
12015021 |
1 |
O2N3H15C16 |
A2B3C15D16 |
-0.45 |
5.43 |
-9.14 |
-0.8 |
0 |
|
|
52218 |
12015022 |
1 |
BrO2N3H14C16 |
AB2C3D14E16 |
0.11 |
4.96 |
-9.32 |
-0.98 |
0 |
|
|
52219 |
12015023 |
1 |
N3H13C16 |
A3B13C16 |
96.11 |
3.99 |
-8.9 |
-0.27 |
0 |
|
|
52220 |
12015024 |
1 |
BrN3H12C16 |
AB3C12D16 |
97.89 |
5.33 |
-9.15 |
-0.44 |
0 |
|
|
52221 |
12015026 |
1 |
BrON3H12C16 |
ABC3D12E16 |
67.48 |
9.43 |
-8.34 |
-1.33 |
0 |
|
|
52222 |
12015027 |
1 |
ON3H19C20 |
AB3C19D20 |
52.5 |
4.44 |
-8.97 |
-0.28 |
0 |
|
|
52223 |
12015028 |
1 |
N3H19C20 |
A3B19C20 |
87.2 |
3.75 |
-8.86 |
-0.17 |
0 |
|
|
52224 |
12015029 |
1 |
BrON3H18C20 |
ABC3D18E20 |
54.3 |
5.31 |
-9.21 |
-0.48 |
0 |
|
|
52225 |
12015030 |
1 |
O2N3H19C20 |
A2B3C19D20 |
20.66 |
6.76 |
-8.28 |
-1.18 |
0 |
|
|
52226 |
12015031 |
1 |
BrO2N3H18C20 |
AB2C3D18E20 |
22.03 |
9.19 |
-8.35 |
-1.34 |
0 |
|
|
52227 |
12015032 |
1 |
BrSN4C20H23 |
ABC4D20E23 |
93.91 |
3.65 |
-8.42 |
-0.47 |
0 |
|
|
52228 |
12015033 |
1 |
ON4C19H24 |
AB4C19D24 |
50.5 |
1.36 |
-8.29 |
-0.11 |
0 |
|
|
52229 |
12015034 |
1 |
ON4C20H24 |
AB4C20D24 |
49.75 |
1.74 |
-8.26 |
-0.11 |
0 |
|
|
52230 |
12015035 |
1 |
S2O3N4H16C17 |
A2B3C4D16E17 |
-26.19 |
2.81 |
-8.99 |
-1.51 |
0 |
|
|
52231 |
12015036 |
1 |
SO3N4C21H22 |
AB3C4D21E22 |
-34.89 |
6.41 |
-9.48 |
-1.48 |
0 |
|
|
52232 |
12015037 |
1 |
ON4H10C12 |
AB4C10D12 |
46.8 |
2.3 |
-9.69 |
-1.4 |
0 |
|
|
52233 |
12015038 |
1 |
ON2F3H13C23 |
AB2C3D13E23 |
-69.77 |
2.73 |
-8.91 |
-1.48 |
0 |
|
|
52234 |
12015039 |
1 |
ON2F3H15C25 |
AB2C3D15E25 |
-57.68 |
3.19 |
-8.88 |
-1.45 |
0 |
|
|
52235 |
12015040 |
1 |
ON2F6H12C24 |
AB2C6D12E24 |
-232.22 |
2.53 |
-9.06 |
-1.6 |
0 |
|
|
52236 |
12015041 |
1 |
ON2F3H15C24 |
AB2C3D15E24 |
-79.29 |
4.67 |
-8.83 |
-1.47 |
0 |
|
|
52237 |
12015043 |
1 |
ClON2F3H12C23 |
ABC2D3E12F23 |
-79.78 |
1.21 |
-9.01 |
-1.57 |
0 |
|
|
52238 |
12015044 |
1 |
ON2F4H12C23 |
AB2C4D12E23 |
-116.57 |
3.2 |
-8.89 |
-1.45 |
0 |
|
|
52239 |
12015045 |
1 |
N2O2F3H15C25 |
A2B2C3D15E25 |
-109.16 |
3.06 |
-9.0 |
-1.62 |
0 |
|
|
52240 |
12015046 |
1 |
F3N3O3H12C23 |
A3B3C3D12E23 |
-71.57 |
2.72 |
-9.19 |
-1.91 |
0 |
|
|
52241 |
12015048 |
1 |
ON2F3H25C27 |
AB2C3D25E27 |
-117.07 |
4.13 |
-8.82 |
-1.47 |
0 |
|
|
52242 |
12015049 |
1 |
ON2F3H25C27 |
AB2C3D25E27 |
-121.09 |
3.58 |
-8.84 |
-1.43 |
0 |
|
|
52243 |
12015050 |
1 |
BrO4C9H9 |
AB4C9D9 |
-104.59 |
4.56 |
-9.29 |
-1.18 |
0 |
|
|
52244 |
12015051 |
2 |
O2C5H6 |
A2B5C6 |
-124.17 |
5.07 |
-9.13 |
-0.79 |
0 |
|
|
52245 |
12015052 |
1 |
BrO5C17H17 |
AB5C17D17 |
-150.84 |
2.59 |
-9.1 |
-0.88 |
0 |
|
|
52246 |
12015053 |
1 |
O5C18H20 |
A5B18C20 |
-169.26 |
3.54 |
-8.92 |
-0.37 |
0 |
|
|
52247 |
12015055 |
1 |
SO4C17H18 |
AB4C17D18 |
-126.9 |
2.0 |
-9.02 |
-0.94 |
0 |
|
|
52248 |
12015056 |
2 |
O2H9C10 |
A2B9C10 |
-96.78 |
2.96 |
-8.7 |
-0.58 |
0 |
|
|
52249 |
12015057 |
1 |
O3C12H16 |
A3B12C16 |
-121.99 |
4.39 |
-8.9 |
0.0 |
0 |
|
|
52250 |
12015058 |
1 |
O5C17H18 |
A5B17C18 |
-158.19 |
4.11 |
-8.82 |
-0.73 |
0 |
|
|
52251 |
12015059 |
1 |
OSeC10H12 |
ABC10D12 |
-31.67 |
1.69 |
-8.83 |
-0.42 |
0 |
|
|
52252 |
12015060 |
1 |
SF3O3C11H19 |
AB3C3D11E19 |
-307.54 |
6.2 |
-10.29 |
-0.28 |
0 |
|
|
52253 |
12015061 |
1 |
O2F3C17H21 |
A2B3C17D21 |
-241.05 |
4.26 |
-10.24 |
-0.82 |
0 |
|
|
52254 |
12015062 |
1 |
FSO3C11H21 |
ABC3D11E21 |
-200.04 |
2.5 |
-10.01 |
0.07 |
0 |
|
|
52255 |
12015063 |
1 |
SF2O3C11H20 |
AB2C3D11E20 |
-250.81 |
5.23 |
-9.93 |
-0.22 |
0 |
|
|
52256 |
12015065 |
1 |
SO3F5C12H19 |
AB3C5D12E19 |
-407.91 |
2.32 |
-10.44 |
-0.3 |
0 |
|
|
52257 |
12015066 |
1 |
SO3F7C13H19 |
AB3C7D13E19 |
-505.32 |
2.7 |
-10.39 |
-0.34 |
0 |