List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
179184 |
76447689 |
1 |
SiO4C21H34 |
AB4C21D34 |
-226.99 |
5.2 |
-8.84 |
0.11 |
0 |
|
|
179185 |
76447690 |
1 |
SiO4C21H36 |
AB4C21D36 |
-262.19 |
3.17 |
-8.88 |
0.22 |
0 |
|
|
179186 |
76447701 |
2 |
OC15H24 |
AB15C24 |
-152.64 |
5.59 |
-9.39 |
0.46 |
0 |
|
|
179187 |
76447838 |
1 |
O26C39H54 |
A26B39C54 |
-1166.48 |
6.62 |
-9.94 |
0.29 |
0 |
|
|
179188 |
76447900 |
2 |
NO2C12H17 |
AB2C12D17 |
-179.58 |
5.24 |
-9.72 |
-0.45 |
0 |
|
|
179189 |
76447901 |
1 |
N2O4C25H38 |
A2B4C25D38 |
-209.8 |
4.2 |
-9.58 |
-0.32 |
0 |
|
|
179190 |
76448036 |
1 |
N9O11C43H71 |
A9B11C43D71 |
-576.92 |
7.31 |
-9.26 |
-0.6 |
0 |
|
|
179191 |
76448037 |
1 |
NOC20H31 |
ABC20D31 |
-73.34 |
1.37 |
-8.74 |
0.99 |
0 |
|
|
179192 |
76448269 |
1 |
NO3C20H39 |
AB3C20D39 |
-202.41 |
6.6 |
-10.27 |
0.78 |
0 |
|
|
179193 |
76449099 |
4 |
O2C4H5 |
A2B4C5 |
-319.84 |
5.37 |
-9.36 |
-0.88 |
1 |
|
|
179194 |
76449397 |
1 |
ClFSN2O4H17C19 |
ABCD2E4F17G19 |
-117.44 |
5.75 |
0.0 |
0.0 |
0 |
|
|
179195 |
76450239 |
1 |
SO2N3H27C29 |
AB2C3D27E29 |
29.77 |
4.11 |
-8.7 |
-0.92 |
0 |
|
|
179196 |
76450240 |
1 |
BrSO4N9C24H30 |
ABC4D9E24F30 |
11.74 |
4.22 |
-8.96 |
-1.35 |
0 |
|
|
179197 |
76450241 |
1 |
O4C29H50 |
A4B29C50 |
-267.37 |
4.09 |
-9.27 |
1.36 |
0 |
|
|
179198 |
76450242 |
1 |
O5C32H54 |
A5B32C54 |
-225.97 |
6.5 |
-6.53 |
-1.04 |
0 |
|
|
179199 |
76450823 |
1 |
BrNSO3F4H36C47 |
ABCD3E4F36G47 |
-118.47 |
6.64 |
-9.42 |
-1.0 |
0 |
|
|
179200 |
76450824 |
1 |
ON5H23C32 |
AB5C23D32 |
163.39 |
7.74 |
-8.43 |
-1.29 |
0 |
|
|
179201 |
76450825 |
1 |
ClN2O4H17C22 |
AB2C4D17E22 |
-92.88 |
3.52 |
-8.48 |
-1.58 |
0 |
|
|
179202 |
76450984 |
1 |
PN6O6C10H13 |
AB6C6D10E13 |
-213.11 |
8.5 |
-9.92 |
-1.33 |
0 |
|
|
179203 |
76450985 |
1 |
PO5N6C10H13 |
AB5C6D10E13 |
-170.62 |
3.79 |
-9.96 |
-1.36 |
0 |
|
|
179204 |
76450986 |
1 |
O25N28C96H150 |
A25B28C96D150 |
-723.56 |
53.34 |
-8.22 |
-1.99 |
1 |
|
|
179205 |
76450987 |
1 |
N3O6C29H42 |
A3B6C29D42 |
-209.17 |
6.74 |
0.0 |
0.0 |
0 |
|
|
179206 |
76450988 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-42.02 |
4.17 |
-9.52 |
-0.04 |
0 |
|
|
179207 |
76451058 |
1 |
NSiO5C28H51 |
ABC5D28E51 |
-332.77 |
6.64 |
-8.68 |
-0.38 |
0 |
|
|
179208 |
76451126 |
1 |
NiSN5H31C51 |
ABC5D31E51 |
508.25 |
4.33 |
-7.12 |
-1.76 |
0 |
|
|
179209 |
76451679 |
1 |
NSO6C24H33 |
ABC6D24E33 |
-255.61 |
4.22 |
-9.21 |
-0.82 |
0 |
|
|
179210 |
76451680 |
2 |
O4C11H14 |
A4B11C14 |
-347.08 |
3.89 |
-10.0 |
-0.78 |
0 |
|
|
179211 |
76452073 |
1 |
SN3O6C8H13 |
AB3C6D8E13 |
-206.27 |
3.74 |
-10.0 |
-1.86 |
0 |
|
|
179212 |
76452108 |
1 |
N3O7C13H23 |
A3B7C13D23 |
-335.1 |
3.91 |
-9.9 |
-0.23 |
0 |
|
|
179213 |
76452121 |
1 |
FOSN3C13H14 |
ABCD3E13F14 |
-38.59 |
2.05 |
-8.94 |
-0.44 |
0 |
|
|
179214 |
76452445 |
1 |
N2O5C28H36 |
A2B5C28D36 |
-147.75 |
3.3 |
-9.31 |
-0.58 |
0 |
|
|
179215 |
76452446 |
1 |
N3O5F6C36H37 |
A3B5C6D36E37 |
-466.39 |
6.59 |
-8.62 |
-1.22 |
0 |
|
|
179216 |
76452447 |
1 |
N3O5F6C37H41 |
A3B5C6D37E41 |
-491.27 |
5.01 |
-8.57 |
-1.28 |
0 |
|
|
179217 |
76452448 |
1 |
F2N3O5C30H31 |
A2B3C5D30E31 |
-224.38 |
4.95 |
-8.52 |
-0.3 |
0 |
|
|
179218 |
76452753 |
1 |
FON6C28H35 |
ABC6D28E35 |
20.45 |
3.64 |
-8.79 |
-0.04 |
0 |
|
|
179219 |
76452946 |
1 |
N6O10C39H68 |
A6B10C39D68 |
-534.66 |
5.67 |
-9.79 |
0.3 |
0 |
|
|
179220 |
76453226 |
1 |
N2O6C27H38 |
A2B6C27D38 |
-214.29 |
4.21 |
-9.24 |
-1.41 |
0 |
|
|
179221 |
76453253 |
1 |
F2O2N7C27H31 |
A2B2C7D27E31 |
-65.29 |
7.12 |
-8.62 |
-0.18 |
0 |
|
|
179222 |
76453263 |
1 |
NSiO5C24H35 |
ABC5D24E35 |
-244.05 |
4.84 |
-8.9 |
-0.67 |
0 |
|
|
179223 |
76453264 |
1 |
O6C15H16 |
A6B15C16 |
-191.58 |
3.76 |
-9.99 |
-2.03 |
0 |
|
|
179224 |
76453265 |
1 |
NO3C17H21 |
AB3C17D21 |
-116.23 |
3.09 |
-9.6 |
0.09 |
0 |
|
|
179225 |
76453266 |
1 |
BrNO4C17H22 |
ABC4D17E22 |
-180.39 |
5.9 |
-9.91 |
-0.5 |
0 |
|
|
179226 |
76453267 |
1 |
BrNO4C17H22 |
ABC4D17E22 |
-180.4 |
6.47 |
-9.88 |
-0.61 |
0 |
|
|
179227 |
76453347 |
1 |
N5O6C13H17 |
A5B6C13D17 |
-199.11 |
3.97 |
-9.15 |
-0.59 |
0 |
|
|
179228 |
76453348 |
1 |
O5N6C14H20 |
A5B6C14D20 |
-148.05 |
3.34 |
-9.21 |
-0.68 |
0 |
|
|
179229 |
76453513 |
1 |
OCl2N7C19H21 |
AB2C7D19E21 |
29.9 |
5.3 |
-9.11 |
-1.07 |
0 |
|
|
179230 |
76453514 |
1 |
OSCl2N6C18H18 |
ABC2D6E18F18 |
25.35 |
6.31 |
-9.03 |
-1.26 |
0 |
|
|
179231 |
76453515 |
1 |
ON6C20H30 |
AB6C20D30 |
-17.82 |
5.41 |
-8.54 |
-0.15 |
0 |
|
|
179232 |
76453784 |
1 |
ClFN4O7H26C27 |
ABC4D7E26F27 |
-271.8 |
8.1 |
-8.32 |
-1.05 |
0 |
|
|
179233 |
76454054 |
1 |
N2F3O11H37C41 |
A2B3C11D37E41 |
-534.74 |
6.21 |
-9.27 |
-2.07 |
0 |