List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
82224 |
49855778 |
1 |
O6C15H22 |
A6B15C22 |
-252.78 |
2.24 |
-9.49 |
0.25 |
0 |
|
|
82225 |
49855779 |
1 |
BrO10C20H23 |
AB10C20D23 |
-426.87 |
2.34 |
-9.26 |
-0.25 |
0 |
|
|
82226 |
49855780 |
1 |
BrClO10C20H22 |
ABC10D20E22 |
-432.66 |
3.72 |
-9.24 |
-0.49 |
0 |
|
|
82227 |
49855781 |
1 |
BrClO10C20H22 |
ABC10D20E22 |
-429.5 |
3.35 |
-9.34 |
-0.57 |
0 |
|
|
82228 |
49855782 |
1 |
BrCl2O10C20H21 |
AB2C10D20E21 |
-438.6 |
2.6 |
-9.61 |
-0.92 |
0 |
|
|
82229 |
49855784 |
1 |
OSN2C10H12 |
ABC2D10E12 |
13.24 |
4.24 |
-9.29 |
-0.88 |
0 |
|
|
82230 |
49855785 |
1 |
ON2C12H14 |
AB2C12D14 |
7.77 |
4.31 |
-9.28 |
-0.45 |
0 |
|
|
82231 |
49855786 |
1 |
O3N4H18C21 |
A3B4C18D21 |
-15.73 |
9.74 |
-9.43 |
-1.02 |
0 |
|
|
82232 |
49855787 |
1 |
SO3N4H14C15 |
AB3C4D14E15 |
-26.02 |
9.33 |
-9.48 |
-1.11 |
0 |
|
|
82233 |
49855788 |
1 |
O3N4H16C17 |
A3B4C16D17 |
-30.93 |
10.04 |
-9.43 |
-0.93 |
0 |
|
|
82234 |
49855789 |
1 |
O3N5H19C21 |
A3B5C19D21 |
19.41 |
9.18 |
-9.21 |
-1.0 |
0 |
|
|
82235 |
49855790 |
1 |
SO3N5C15H15 |
AB3C5D15E15 |
8.95 |
8.14 |
-9.23 |
-1.0 |
0 |
|
|
82236 |
49855791 |
1 |
N2O4C19H30 |
A2B4C19D30 |
-180.23 |
6.55 |
-8.49 |
-0.22 |
0 |
|
|
82237 |
49855792 |
1 |
N2O4C19H30 |
A2B4C19D30 |
-180.57 |
3.34 |
-8.46 |
-0.13 |
0 |
|
|
82238 |
49855793 |
1 |
OBr2N2H6C12 |
AB2C2D6E12 |
47.98 |
7.7 |
-8.74 |
-1.96 |
0 |
|
|
82239 |
49855794 |
1 |
BrON2H9C13 |
ABC2D9E13 |
51.85 |
3.73 |
-8.8 |
-1.72 |
0 |
|
|
82240 |
49855795 |
1 |
OBr2N2H8C13 |
AB2C2D8E13 |
52.94 |
4.56 |
-8.85 |
-1.88 |
0 |
|
|
82241 |
49855796 |
1 |
BrON2H9C13 |
ABC2D9E13 |
49.73 |
4.4 |
-8.93 |
-1.75 |
0 |
|
|
82242 |
49855798 |
1 |
OBr2N2H8C13 |
AB2C2D8E13 |
52.21 |
5.01 |
-8.91 |
-1.87 |
0 |
|
|
82243 |
49855799 |
1 |
BrN2H9C13 |
AB2C9D13 |
78.85 |
2.66 |
-9.27 |
-1.66 |
0 |
|
|
82244 |
49855800 |
2 |
NOC9H9 |
ABC9D9 |
-2.19 |
4.43 |
-8.69 |
-0.76 |
0 |
|
|
82245 |
49855802 |
2 |
NOC9H9 |
ABC9D9 |
-4.5 |
5.02 |
-8.95 |
-0.86 |
0 |
|
|
82246 |
49855803 |
2 |
NOC9H9 |
ABC9D9 |
-0.57 |
3.21 |
-8.72 |
-0.78 |
0 |
|
|
82247 |
49855804 |
2 |
NO2C9H9 |
AB2C9D9 |
-110.07 |
6.92 |
-9.59 |
-1.13 |
0 |
|
|
82248 |
49855805 |
1 |
N2O2H10C13 |
A2B2C10D13 |
1.55 |
5.09 |
-9.47 |
-1.06 |
0 |
|
|
82249 |
49855806 |
2 |
NO2C9H9 |
AB2C9D9 |
-109.69 |
8.02 |
-9.51 |
-1.13 |
0 |
|
|
82250 |
49855807 |
3 |
ON2C10H10 |
AB2C10D10 |
11.26 |
6.32 |
-8.58 |
-0.9 |
0 |
|
|
82251 |
49855808 |
1 |
O2N5C28H29 |
A2B5C28D29 |
13.41 |
6.91 |
-8.41 |
-0.68 |
0 |
|
|
82252 |
49855809 |
1 |
O2N5H27C28 |
A2B5C27D28 |
54.91 |
7.48 |
-8.54 |
-0.96 |
0 |
|
|
82253 |
49855810 |
1 |
O2N5C28H29 |
A2B5C28D29 |
19.76 |
7.17 |
-8.43 |
-0.78 |
0 |
|
|
82254 |
49855812 |
1 |
PN5O6C14H20 |
AB5C6D14E20 |
-237.82 |
2.3 |
-9.21 |
-0.66 |
0 |
|
|
82256 |
49855814 |
1 |
O3C18H20 |
A3B18C20 |
-95.15 |
6.06 |
-9.41 |
-0.58 |
0 |
|
|
82257 |
49855815 |
2 |
NO3C10H17 |
AB3C10D17 |
-211.63 |
5.63 |
-9.4 |
-0.91 |
0 |
|
|
82258 |
49855816 |
1 |
N2O6C19H32 |
A2B6C19D32 |
-215.43 |
7.78 |
-9.19 |
-1.13 |
0 |
|
|
82259 |
49855817 |
1 |
N2O6C19H30 |
A2B6C19D30 |
-213.15 |
5.16 |
-9.62 |
-1.21 |
0 |
|
|
82260 |
49855818 |
1 |
SN5O9C39H45 |
AB5C9D39E45 |
-260.17 |
6.31 |
-9.38 |
-0.99 |
0 |
|
|
82261 |
49855819 |
1 |
SF2N5O9C38H43 |
AB2C5D9E38F43 |
-289.79 |
7.15 |
-7.21 |
-0.96 |
0 |
|
|
82262 |
49855820 |
1 |
SN5O9C40H47 |
AB5C9D40E47 |
-275.54 |
7.6 |
-8.89 |
-0.65 |
0 |
|
|
82263 |
49855821 |
1 |
SN4O9C39H48 |
AB4C9D39E48 |
-288.03 |
4.96 |
-9.01 |
-0.24 |
0 |
|
|
82264 |
49855822 |
1 |
SF2N5O9C39H51 |
AB2C5D9E39F51 |
-437.06 |
5.1 |
-9.2 |
-0.94 |
0 |
|
|
82268 |
49855828 |
1 |
FISN3O5C20H25 |
ABCD3E5F20G25 |
-184.86 |
5.66 |
-8.64 |
-1.08 |
0 |
|
|
82269 |
49855829 |
1 |
FNO4H16C19 |
ABC4D16E19 |
-144.77 |
2.79 |
-9.22 |
-1.16 |
0 |
|
|
82270 |
49855830 |
1 |
FNO4H16C19 |
ABC4D16E19 |
-150.38 |
3.03 |
-9.23 |
-1.18 |
0 |
|
|
82271 |
49855831 |
1 |
FNO4H14C18 |
ABC4D14E18 |
-141.9 |
2.75 |
-9.27 |
-1.19 |
0 |
|
|
82272 |
49855832 |
2 |
NO2C18H31 |
AB2C18D31 |
-240.2 |
2.61 |
-8.75 |
1.7 |
0 |
|
|
82273 |
49855833 |
1 |
N3O3C17H19 |
A3B3C17D19 |
-50.1 |
4.63 |
-9.22 |
-0.62 |
0 |
|
|
82274 |
49855835 |
1 |
O3N4H18C19 |
A3B4C18D19 |
9.68 |
4.2 |
-9.36 |
-1.3 |
0 |
|
|
82275 |
49855836 |
1 |
N2O3C23H28 |
A2B3C23D28 |
-73.56 |
1.28 |
-9.46 |
-0.61 |
0 |
|
|
82276 |
49855837 |
1 |
ClN2O3C17H21 |
AB2C3D17E21 |
-94.27 |
4.0 |
-9.64 |
-1.06 |
0 |
|
|
82277 |
49855839 |
1 |
SN2O4C21H26 |
AB2C4D21E26 |
-109.22 |
8.3 |
-9.38 |
-0.64 |
0 |