List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
4873 |
12210 |
1 |
OC8H16 |
AB8C16 |
-76.59 |
3.04 |
-9.93 |
0.8 |
0 |
|
|
4874 |
12211 |
1 |
NC3O5H7 |
AB3C5D7 |
-128.61 |
3.26 |
-10.82 |
-1.19 |
0 |
|
|
4875 |
12212 |
1 |
NOC7H15 |
ABC7D15 |
-38.48 |
1.65 |
-9.64 |
0.98 |
0 |
|
|
4876 |
12213 |
1 |
ON3C5H11 |
AB3C5D11 |
-36.62 |
4.42 |
-9.22 |
0.5 |
0 |
|
|
4877 |
12214 |
1 |
O5C6H12 |
A5B6C12 |
-242.31 |
3.94 |
-10.61 |
0.26 |
0 |
|
|
4878 |
12215 |
2 |
O2C3H4 |
A2B3C4 |
-153.08 |
0.27 |
-11.25 |
-1.3 |
0 |
|
|
4879 |
12216 |
1 |
OC9H20 |
AB9C20 |
-94.31 |
1.97 |
-10.27 |
2.9 |
0 |
|
|
4880 |
12217 |
2 |
OC4H8 |
AB4C8 |
-123.77 |
1.94 |
-10.72 |
0.86 |
0 |
|
|
4881 |
12218 |
1 |
ClNC3H10 |
ABC3D10 |
-50.47 |
5.85 |
-10.02 |
1.83 |
0 |
|
|
4882 |
12219 |
1 |
NC3H9 |
AB3C9 |
-9.05 |
1.71 |
-8.88 |
3.15 |
0 |
|
|
4883 |
12220 |
4 |
CH2 |
AB2 |
-3.17 |
0.08 |
-9.46 |
1.49 |
0 |
|
|
4884 |
12223 |
2 |
CFH2 |
ABC2 |
-104.93 |
0.0 |
-12.47 |
2.29 |
0 |
|
|
4885 |
12224 |
2 |
CIH2 |
ABC2 |
18.28 |
0.0 |
-10.05 |
-1.74 |
0 |
|
|
4886 |
12225 |
1 |
IOC2H5 |
ABC2D5 |
-39.02 |
1.4 |
-10.07 |
-1.15 |
0 |
|
|
4887 |
12226 |
1 |
NC3H5 |
AB3C5 |
38.44 |
3.37 |
-11.32 |
2.26 |
0 |
|
|
4888 |
12227 |
1 |
CON2H4 |
ABC2D4 |
2.31 |
1.86 |
-9.2 |
0.65 |
0 |
|
|
4889 |
12229 |
1 |
CON2H4 |
ABC2D4 |
-18.37 |
3.81 |
-10.3 |
0.58 |
0 |
|
|
4890 |
12230 |
1 |
SC3H8 |
AB3C8 |
-11.86 |
1.74 |
-8.46 |
0.9 |
0 |
|
|
4891 |
12232 |
2 |
CSH3 |
ABC3 |
-5.5 |
2.23 |
-8.88 |
-0.83 |
0 |
|
|
4892 |
12234 |
1 |
NSC5H14 |
ABC5D14 |
16.29 |
3.48 |
0.0 |
0.0 |
1 |
|
|
4893 |
12235 |
1 |
OC7H16 |
AB7C16 |
-89.08 |
1.91 |
-10.17 |
3.04 |
0 |
|
|
4894 |
12237 |
1 |
NP2O6C7H19 |
AB2C6D7E19 |
-410.33 |
2.14 |
-9.63 |
0.49 |
0 |
|
|
4895 |
12239 |
1 |
SO4C8H18 |
AB4C8D18 |
-198.44 |
3.68 |
-11.25 |
-0.67 |
0 |
|
|
4896 |
12242 |
1 |
OC8H18 |
AB8C18 |
-93.26 |
1.92 |
-10.42 |
3.0 |
0 |
|
|
4897 |
12243 |
6 |
CH2 |
AB2 |
-16.76 |
0.68 |
-9.14 |
1.6 |
0 |
|
|
4898 |
12244 |
1 |
NC5H9 |
AB5C9 |
4.36 |
4.01 |
-11.84 |
1.38 |
0 |
|
|
4899 |
12245 |
1 |
ClC5H11 |
AB5C11 |
-43.62 |
2.57 |
-10.52 |
1.01 |
0 |
|
|
4900 |
12247 |
1 |
OC5H10 |
AB5C10 |
-48.65 |
2.03 |
-10.19 |
1.0 |
0 |
|
|
4901 |
12248 |
1 |
OC5H8 |
AB5C8 |
-38.17 |
4.6 |
-10.08 |
-0.14 |
0 |
|
|
4902 |
12249 |
1 |
NC5H13 |
AB5C13 |
-19.57 |
1.63 |
-8.84 |
3.12 |
0 |
|
|
4903 |
12250 |
1 |
OC5H12 |
AB5C12 |
-62.94 |
1.64 |
-9.63 |
2.28 |
0 |
|
|
4904 |
12251 |
3 |
COH2 |
ABC2 |
-128.12 |
5.54 |
-10.91 |
0.51 |
0 |
|
|
4905 |
12252 |
1 |
NC2O3H5 |
AB2C3D5 |
-59.57 |
3.11 |
-11.28 |
-0.78 |
0 |
|
|
4906 |
12256 |
1 |
OC5H12 |
AB5C12 |
-67.3 |
1.45 |
-9.62 |
2.4 |
0 |
|
|
4907 |
12257 |
2 |
OC2H4 |
AB2C4 |
-100.83 |
2.2 |
-10.99 |
0.6 |
0 |
|
|
4908 |
12258 |
1 |
NOSC3H7 |
ABCD3E7 |
-32.98 |
3.89 |
-9.42 |
-0.35 |
0 |
|
|
4909 |
12259 |
1 |
NC2O3H5 |
AB2C3D5 |
-43.86 |
3.47 |
-11.72 |
-0.94 |
0 |
|
|
4910 |
12260 |
7 |
CH2 |
AB2 |
-23.01 |
0.66 |
-9.16 |
1.59 |
0 |
|
|
4911 |
12262 |
1 |
O2C5H12 |
A2B5C12 |
-122.03 |
3.0 |
-10.42 |
2.67 |
0 |
|
|
4912 |
12263 |
1 |
NO2C4H7 |
AB2C4D7 |
-104.35 |
2.9 |
-10.74 |
0.03 |
0 |
|
|
4913 |
12266 |
1 |
OC6H8 |
AB6C8 |
-28.42 |
0.53 |
-8.75 |
0.89 |
0 |
|
|
4914 |
12270 |
2 |
IH2C3 |
AB2C3 |
56.85 |
1.38 |
-9.56 |
-1.23 |
0 |
|
|
4915 |
12272 |
1 |
IOH5C6 |
ABC5D6 |
-4.48 |
2.67 |
-9.38 |
-0.96 |
0 |
|
|
4916 |
12273 |
1 |
NO2C5H5 |
AB2C5D5 |
-54.46 |
8.1 |
-9.46 |
-0.16 |
0 |
|
|
4917 |
12274 |
1 |
NBr2H3C5 |
AB2C3D5 |
23.19 |
3.52 |
-10.02 |
-0.94 |
0 |
|
|
4918 |
12275 |
2 |
ClC4H4 |
AB4C4 |
-5.18 |
0.93 |
-9.78 |
-0.43 |
0 |
|
|
4919 |
12276 |
2 |
NH2C4 |
AB2C4 |
88.51 |
3.83 |
-10.7 |
-1.35 |
0 |
|
|
4920 |
12277 |
1 |
NC8H19 |
AB8C19 |
-37.12 |
1.37 |
-8.63 |
3.2 |
0 |
|
|
4921 |
12278 |
1 |
O2C7H14 |
A2B7C14 |
-122.84 |
2.16 |
-10.89 |
0.91 |
0 |
|
|
4922 |
12283 |
1 |
N2O2C5H6 |
A2B2C5D6 |
-88.8 |
5.67 |
-10.15 |
-0.54 |
0 |