List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
52873 |
14709119 |
1 |
N2O4H14C19 |
A2B4C14D19 |
-63.49 |
4.78 |
-8.25 |
-1.91 |
0 |
|
|
52874 |
14709120 |
1 |
N3O3H17C20 |
A3B3C17D20 |
-26.53 |
4.21 |
-8.27 |
-1.9 |
0 |
|
|
52875 |
14709123 |
1 |
BrN2O3H11C18 |
AB2C3D11E18 |
-23.6 |
4.15 |
-9.14 |
-2.12 |
0 |
|
|
52876 |
14709124 |
1 |
IN2O3H11C18 |
AB2C3D11E18 |
-9.35 |
4.14 |
-9.16 |
-2.12 |
-1 |
|
|
52877 |
14709128 |
1 |
ClFeNSO4H17C18 |
ABCDE4F17G18 |
3.11 |
6.34 |
0.0 |
0.0 |
0 |
|
|
52878 |
14709129 |
1 |
ClNSO4H12C13 |
ABCD4E12F13 |
-33.8 |
4.48 |
-8.9 |
-0.85 |
-1 |
|
|
52879 |
14709130 |
1 |
ClFeNSO4H17C18 |
ABCDE4F17G18 |
-0.58 |
8.15 |
0.0 |
0.0 |
-1 |
|
|
52880 |
14709132 |
1 |
BrFeNSO4H17C18 |
ABCDE4F17G18 |
-5.33 |
2.97 |
0.0 |
0.0 |
-1 |
|
|
52881 |
14709136 |
1 |
BrFeNSO4H17C18 |
ABCDE4F17G18 |
-6.41 |
4.04 |
0.0 |
0.0 |
0 |
|
|
52882 |
14709137 |
1 |
BrNSO4H12C13 |
ABCD4E12F13 |
-22.65 |
4.58 |
-8.88 |
-0.83 |
0 |
|
|
52883 |
14709139 |
1 |
ClNSO4C14H14 |
ABCD4E14F14 |
-40.79 |
5.85 |
-8.92 |
-0.78 |
-1 |
|
|
52884 |
14709140 |
1 |
ClFeNSO4C19H19 |
ABCDE4F19G19 |
-14.67 |
8.33 |
0.0 |
0.0 |
-1 |
|
|
52885 |
14709142 |
1 |
ClFeNSO4C19H19 |
ABCDE4F19G19 |
-19.07 |
5.07 |
0.0 |
0.0 |
0 |
|
|
52886 |
14709143 |
1 |
ClNSO4C14H14 |
ABCD4E14F14 |
-40.86 |
5.28 |
-8.91 |
-0.78 |
-2 |
|
|
52887 |
14709144 |
1 |
ClFeNSO2H16C19 |
ABCDE2F16G19 |
44.7 |
5.82 |
-8.74 |
-0.46 |
-2 |
|
|
52888 |
14709146 |
1 |
ClFeNSO2H16C19 |
ABCDE2F16G19 |
114.08 |
3.29 |
-7.34 |
-1.28 |
0 |
|
|
52889 |
14709147 |
1 |
ClNSO2H12C14 |
ABCD2E12F14 |
1.07 |
4.4 |
-9.45 |
-0.82 |
-2 |
|
|
52890 |
14709148 |
1 |
ClFeNSO2H16C19 |
ABCDE2F16G19 |
38.78 |
4.28 |
-8.34 |
-0.82 |
0 |
|
|
52891 |
14709149 |
1 |
ClNSO2H12C14 |
ABCD2E12F14 |
2.83 |
8.68 |
-9.54 |
-0.92 |
-2 |
|
|
52892 |
14709150 |
1 |
ClFeNSO2H18C20 |
ABCDE2F18G20 |
30.71 |
4.88 |
-8.27 |
-0.67 |
-2 |
|
|
52893 |
14709152 |
1 |
ClFeNSO2H18C20 |
ABCDE2F18G20 |
26.13 |
6.01 |
-8.27 |
-0.7 |
0 |
|
|
52894 |
14709153 |
1 |
ClNSO2H14C15 |
ABCD2E14F15 |
-7.56 |
5.07 |
-9.39 |
-0.8 |
-2 |
|
|
52895 |
14709154 |
1 |
ClFeNSO2H18C20 |
ABCDE2F18G20 |
42.98 |
11.14 |
-7.23 |
-1.27 |
-2 |
|
|
52896 |
14709158 |
1 |
FeNO2S3H25C30 |
ABC2D3E25F30 |
143.56 |
4.76 |
-8.55 |
-1.02 |
0 |
|
|
52897 |
14709163 |
1 |
ON2H8C10 |
AB2C8D10 |
55.6 |
5.92 |
-10.26 |
-0.93 |
0 |
|
|
52898 |
14709165 |
1 |
SN2O5C15H20 |
AB2C5D15E20 |
-188.42 |
6.5 |
-10.32 |
-0.86 |
0 |
|
|
52899 |
14709166 |
1 |
N2O2H12C17 |
A2B2C12D17 |
31.52 |
3.99 |
-10.02 |
-0.76 |
0 |
|
|
52900 |
14709174 |
1 |
NF2H3C8 |
AB2C3D8 |
25.03 |
4.73 |
-10.84 |
-1.29 |
0 |
|
|
52901 |
14709175 |
1 |
OF2H14C20 |
AB2C14D20 |
-2.08 |
2.0 |
-9.69 |
-0.36 |
0 |
|
|
52902 |
14709176 |
1 |
OF2H4C8 |
AB2C4D8 |
-32.59 |
5.38 |
-10.45 |
-1.26 |
0 |
|
|
52903 |
14709177 |
2 |
FOH5C6 |
ABC5D6 |
-89.37 |
2.29 |
-10.11 |
-1.24 |
0 |
|
|
52904 |
14709179 |
1 |
SiF2C10H12 |
AB2C10D12 |
-53.15 |
3.4 |
-9.85 |
-0.23 |
1 |
|
|
52905 |
14709182 |
1 |
F2H15C20 |
A2B15C20 |
37.24 |
2.91 |
0.0 |
0.0 |
0 |
|
|
52906 |
14709184 |
1 |
S2O6C21H28 |
A2B6C21D28 |
-245.75 |
2.16 |
-9.95 |
-0.47 |
0 |
|
|
52907 |
14709185 |
2 |
Br2C3H5 |
A2B3C5 |
-26.1 |
0.6 |
-10.59 |
-1.28 |
0 |
|
|
52908 |
14709186 |
2 |
C8H9 |
A8B9 |
32.09 |
0.07 |
-8.38 |
-0.15 |
0 |
|
|
52909 |
14709188 |
2 |
BO2C14H14 |
AB2C14D14 |
-212.38 |
2.22 |
-9.5 |
-0.28 |
0 |
|
|
52910 |
14709191 |
2 |
BFO2H13C14 |
ABC2D13E14 |
-334.67 |
2.03 |
-9.44 |
-0.16 |
0 |
|
|
52911 |
14709192 |
2 |
BFO2H13C14 |
ABC2D13E14 |
-306.32 |
1.42 |
-9.48 |
-0.25 |
0 |
|
|
52912 |
14709194 |
1 |
B2N2O4C35H38 |
A2B2C4D35E38 |
-134.76 |
6.52 |
-8.32 |
-0.26 |
0 |
|
|
52913 |
14709196 |
1 |
B2N2O4C33H34 |
A2B2C4D33E34 |
-167.98 |
6.41 |
-8.73 |
-1.02 |
0 |
|
|
52915 |
14709201 |
1 |
NB2O4C36H39 |
AB2C4D36E39 |
-165.71 |
2.83 |
-8.77 |
-0.24 |
0 |
|
|
52917 |
14709204 |
2 |
BNO2C16H16 |
ABC2D16E16 |
-153.04 |
3.87 |
-8.74 |
-0.43 |
0 |
|
|
52918 |
14709205 |
2 |
BNO2C16H16 |
ABC2D16E16 |
-168.92 |
2.41 |
-9.51 |
-0.52 |
0 |
|
|
52921 |
14709211 |
2 |
BFO2H13C14 |
ABC2D13E14 |
-338.37 |
6.3 |
-9.6 |
-0.33 |
0 |
|
|
52922 |
14709212 |
1 |
B2F2N2O4C35H36 |
A2B2C2D4E35F36 |
-236.81 |
2.08 |
-8.82 |
-0.58 |
0 |
|
|
52923 |
14709213 |
2 |
BFO2H13C14 |
ABC2D13E14 |
31.32 |
11.43 |
-8.31 |
-1.88 |
0 |
|
|
52924 |
14709217 |
1 |
O3C12H20 |
A3B12C20 |
-146.11 |
2.28 |
-9.41 |
0.58 |
0 |
|
|
52925 |
14709218 |
1 |
O3C15H26 |
A3B15C26 |
-153.6 |
2.7 |
-9.28 |
1.2 |
0 |
|
|
52926 |
14709219 |
3 |
OC5H8 |
AB5C8 |
-138.33 |
4.0 |
-9.29 |
0.56 |
0 |