List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
82066 |
49855551 |
1 |
Si2O10C45H76 |
A2B10C45D76 |
-566.19 |
2.42 |
-8.68 |
0.28 |
0 |
|
|
82067 |
49855553 |
1 |
N4C17H24 |
A4B17C24 |
50.17 |
3.39 |
-8.38 |
-0.18 |
0 |
|
|
82068 |
49855554 |
1 |
N4C17H24 |
A4B17C24 |
46.19 |
4.65 |
-8.22 |
0.02 |
0 |
|
|
82069 |
49855555 |
1 |
SO2N4C23H28 |
AB2C4D23E28 |
-2.84 |
6.64 |
-8.25 |
-0.58 |
0 |
|
|
82070 |
49855557 |
2 |
ON3C9H13 |
AB3C9D13 |
-39.97 |
4.33 |
-8.41 |
-0.16 |
0 |
|
|
82071 |
49855559 |
2 |
N2C7H9 |
A2B7C9 |
41.73 |
3.85 |
-8.34 |
-0.07 |
0 |
|
|
82072 |
49855560 |
1 |
SO4N5H33C35 |
AB4C5D33E35 |
-39.46 |
2.86 |
-8.6 |
-1.0 |
0 |
|
|
82073 |
49855562 |
1 |
SO4N6C34H38 |
AB4C6D34E38 |
-73.27 |
4.13 |
-8.49 |
-0.91 |
0 |
|
|
82074 |
49855564 |
2 |
ON2H6C8 |
AB2C6D8 |
61.75 |
7.4 |
-8.56 |
-1.39 |
0 |
|
|
82075 |
49855565 |
1 |
N4O4H12C15 |
A4B4C12D15 |
24.97 |
7.27 |
-8.8 |
-1.88 |
0 |
|
|
82076 |
49855566 |
1 |
N3O3H15C16 |
A3B3C15D16 |
-12.99 |
4.39 |
-8.32 |
-0.68 |
0 |
|
|
82077 |
49855568 |
1 |
ClFN4O4H20C28 |
ABC4D4E20F28 |
-27.68 |
4.0 |
-8.9 |
-1.44 |
0 |
|
|
82078 |
49855569 |
1 |
ClFSO3N4H20C28 |
ABCD3E4F20G28 |
8.8 |
2.02 |
-8.78 |
-1.63 |
0 |
|
|
82079 |
49855570 |
1 |
NSiO7C38H45 |
ABC7D38E45 |
-227.05 |
4.92 |
-8.34 |
-0.2 |
0 |
|
|
82080 |
49855572 |
2 |
NO4H15C16 |
AB4C15D16 |
-122.16 |
8.76 |
-8.35 |
-1.39 |
0 |
|
|
82081 |
49855573 |
1 |
NO5C25H25 |
AB5C25D25 |
-106.18 |
6.42 |
-8.24 |
-0.15 |
0 |
|
|
82082 |
49855574 |
1 |
NO5C25H25 |
AB5C25D25 |
-105.0 |
2.75 |
-8.2 |
-0.25 |
0 |
|
|
82083 |
49855575 |
1 |
BClN2O4C25H32 |
ABC2D4E25F32 |
-254.35 |
2.2 |
-9.35 |
-0.48 |
0 |
|
|
82084 |
49855577 |
1 |
BN2O5C26H35 |
AB2C5D26E35 |
-282.18 |
4.72 |
-9.04 |
-0.2 |
0 |
|
|
82085 |
49855579 |
1 |
BFN2O4C16H24 |
ABC2D4E16F24 |
-304.16 |
1.51 |
-9.59 |
-0.29 |
0 |
|
|
82086 |
49855581 |
1 |
BClN2O4C31H40 |
ABC2D4E31F40 |
-229.95 |
9.26 |
-9.32 |
-0.27 |
0 |
|
|
82087 |
49855582 |
1 |
BClN2O4C31H40 |
ABC2D4E31F40 |
-231.97 |
6.42 |
-9.66 |
-0.3 |
0 |
|
|
82088 |
49855583 |
1 |
BN2O5C32H43 |
AB2C5D32E43 |
-260.88 |
8.32 |
-8.95 |
0.01 |
0 |
|
|
82089 |
49855584 |
1 |
BN2O5C32H43 |
AB2C5D32E43 |
-263.26 |
8.62 |
-9.04 |
0.01 |
0 |
|
|
82090 |
49855585 |
2 |
O5H16C20 |
A5B16C20 |
-277.73 |
3.98 |
-9.1 |
-0.9 |
0 |
|
|
82091 |
49855586 |
2 |
O5H18C21 |
A5B18C21 |
-280.72 |
4.68 |
-8.93 |
-0.9 |
0 |
|
|
82092 |
49855587 |
1 |
O10H38C43 |
A10B38C43 |
-294.01 |
6.66 |
-8.94 |
-0.72 |
0 |
|
|
82093 |
49855588 |
1 |
O2N5C22H23 |
A2B5C22D23 |
56.02 |
6.47 |
-9.01 |
-0.84 |
0 |
|
|
82094 |
49855590 |
1 |
N2O2S2C9H12 |
A2B2C2D9E12 |
-17.14 |
4.23 |
-9.3 |
-1.08 |
0 |
|
|
82095 |
49855591 |
1 |
SN4O4H18C20 |
AB4C4D18E20 |
-48.56 |
4.27 |
-9.51 |
-1.3 |
0 |
|
|
82096 |
49855593 |
1 |
SO4N5H19C20 |
AB4C5D19E20 |
-13.12 |
5.41 |
-9.37 |
-1.3 |
0 |
|
|
82097 |
49855594 |
1 |
S2O4N5C14H15 |
A2B4C5D14E15 |
-23.13 |
7.77 |
-9.23 |
-1.27 |
0 |
|
|
82098 |
49855598 |
1 |
N2O3C20H26 |
A2B3C20D26 |
-98.82 |
4.49 |
-8.42 |
-0.3 |
0 |
|
|
82099 |
49855599 |
1 |
N2O3C20H26 |
A2B3C20D26 |
-103.88 |
2.53 |
-8.73 |
-0.31 |
0 |
|
|
82100 |
49855600 |
1 |
N2O3C22H28 |
A2B3C22D28 |
-79.72 |
4.62 |
-8.67 |
-0.32 |
0 |
|
|
82101 |
49855601 |
1 |
N2O3H12C15 |
A2B3C12D15 |
-45.56 |
3.65 |
-9.33 |
-1.43 |
0 |
|
|
82102 |
49855606 |
1 |
N2O2H10C13 |
A2B2C10D13 |
0.24 |
6.36 |
-9.1 |
-1.17 |
0 |
|
|
82103 |
49855607 |
2 |
NOC9H9 |
ABC9D9 |
-5.01 |
4.45 |
-9.14 |
-0.7 |
0 |
|
|
82104 |
49855608 |
1 |
ClO2N5C28H28 |
AB2C5D28E28 |
4.87 |
7.56 |
-8.41 |
-1.24 |
0 |
|
|
82105 |
49855609 |
1 |
ClO2N5H26C27 |
AB2C5D26E27 |
21.98 |
7.61 |
-8.51 |
-1.22 |
0 |
|
|
82106 |
49855611 |
1 |
ClO2N5H24C27 |
AB2C5D24E27 |
58.89 |
6.47 |
-8.54 |
-1.3 |
0 |
|
|
82107 |
49855616 |
1 |
PO4N5C14H18 |
AB4C5D14E18 |
-126.52 |
3.51 |
-8.84 |
-0.26 |
0 |
|
|
82108 |
49855617 |
1 |
PN5O6C18H28 |
AB5C6D18E28 |
-252.28 |
3.81 |
-9.17 |
-0.62 |
0 |
|
|
82109 |
49855618 |
1 |
SN5O9C39H47 |
AB5C9D39E47 |
-291.51 |
11.88 |
-9.29 |
-1.18 |
0 |
|
|
82110 |
49855619 |
1 |
SN5O9C39H47 |
AB5C9D39E47 |
-298.94 |
11.36 |
-9.2 |
-1.23 |
0 |
|
|
82111 |
49855620 |
1 |
SF2N5O9C38H43 |
AB2C5D9E38F43 |
-385.32 |
10.71 |
-9.29 |
-0.94 |
0 |
|
|
82115 |
49855636 |
1 |
N3O3H17C19 |
A3B3C17D19 |
-25.85 |
2.52 |
-8.91 |
-0.79 |
0 |
|
|
82116 |
49855637 |
1 |
ClN2O3C21H21 |
AB2C3D21E21 |
-53.72 |
4.92 |
-9.47 |
-0.72 |
0 |
|
|
82117 |
49855638 |
1 |
N3O4C17H19 |
A3B4C17D19 |
-72.18 |
1.94 |
-9.68 |
-0.76 |
0 |
|
|
82118 |
49855639 |
1 |
N2O3C15H18 |
A2B3C15D18 |
-64.53 |
4.21 |
-9.66 |
-0.73 |
0 |