List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
325672 |
126684424 |
1 |
O7C20H34 |
A7B20C34 |
-333.29 |
2.14 |
-10.0 |
-1.01 |
0 |
|
|
325673 |
126684426 |
1 |
FSO4N5C20H22 |
ABC4D5E20F22 |
-128.5 |
6.09 |
-8.74 |
-1.17 |
0 |
|
|
325674 |
126684427 |
1 |
NF3C16H24 |
AB3C16D24 |
-186.68 |
6.58 |
-8.73 |
-0.1 |
0 |
|
|
325675 |
126684431 |
1 |
ClSO4N5C20H22 |
ABC4D5E20F22 |
-91.76 |
4.26 |
-8.72 |
-1.29 |
0 |
|
|
325676 |
126684439 |
2 |
NC6H9 |
AB6C9 |
21.48 |
3.94 |
-8.63 |
0.34 |
0 |
|
|
325677 |
126684441 |
1 |
SN5O5C21H25 |
AB5C5D21E25 |
-124.21 |
4.69 |
-8.14 |
-0.91 |
0 |
|
|
325678 |
126684443 |
1 |
SC10H16 |
AB10C16 |
46.86 |
3.91 |
-6.99 |
0.7 |
0 |
|
|
325679 |
126684447 |
1 |
ClON2C5H9 |
ABC2D5E9 |
-0.09 |
3.18 |
-9.64 |
-0.3 |
0 |
|
|
325680 |
126684462 |
1 |
Br2N2O2C57H70 |
A2B2C2D57E70 |
12.53 |
1.23 |
-8.71 |
-1.71 |
0 |
|
|
325681 |
126684470 |
2 |
NS2O3C34H50 |
AB2C3D34E50 |
-249.99 |
3.39 |
-8.24 |
-1.48 |
0 |
|
|
325682 |
126684472 |
1 |
ISC3F3H6 |
ABC3D3E6 |
-164.09 |
4.14 |
-8.43 |
-1.28 |
0 |
|
|
325683 |
126684479 |
1 |
N3C13H15 |
A3B13C15 |
38.53 |
4.63 |
-9.41 |
-0.39 |
0 |
|
|
325684 |
126684480 |
2 |
NH10C11 |
AB10C11 |
65.79 |
2.53 |
-8.83 |
-0.59 |
0 |
|
|
325685 |
126684482 |
1 |
N4O7C52H78 |
A4B7C52D78 |
-345.88 |
3.14 |
-9.24 |
-0.38 |
0 |
|
|
325686 |
126684483 |
1 |
O4C25H42 |
A4B25C42 |
-185.96 |
4.17 |
-8.76 |
0.53 |
0 |
|
|
325687 |
126684484 |
1 |
N3O7C55H83 |
A3B7C55D83 |
-371.95 |
5.32 |
-9.12 |
-0.5 |
0 |
|
|
325688 |
126684498 |
1 |
ClFN2O3H18C20 |
ABC2D3E18F20 |
-118.67 |
7.55 |
-9.77 |
-0.77 |
0 |
|
|
325689 |
126684504 |
1 |
N2O3C17H26 |
A2B3C17D26 |
-51.44 |
4.09 |
-9.68 |
0.17 |
0 |
|
|
325690 |
126684507 |
1 |
ClFNO5C26H33 |
ABCD5E26F33 |
-292.02 |
2.83 |
-9.28 |
-0.52 |
0 |
|
|
325691 |
126684514 |
1 |
FCl2N2O2C19H21 |
AB2C2D2E19F21 |
-122.93 |
4.05 |
-9.41 |
-0.71 |
0 |
|
|
325692 |
126684516 |
1 |
FCl2N2O4C24H29 |
AB2C2D4E24F29 |
-242.43 |
4.15 |
-9.42 |
-0.81 |
0 |
|
|
325693 |
126684520 |
1 |
ClFNO4C21H23 |
ABCD4E21F23 |
-202.58 |
3.27 |
-9.43 |
-0.6 |
0 |
|
|
325694 |
126684531 |
1 |
ClFNSO7C32H37 |
ABCDE7F32G37 |
-340.53 |
7.12 |
-9.21 |
-0.76 |
0 |
|
|
325695 |
126684535 |
1 |
ClFN2O5C20H20 |
ABC2D5E20F20 |
-233.88 |
7.02 |
-9.41 |
-0.48 |
0 |
|
|
325696 |
126684544 |
1 |
ClFN2O2C23H30 |
ABC2D2E23F30 |
-123.7 |
2.08 |
-8.78 |
-0.57 |
0 |
|
|
325697 |
126684546 |
1 |
FON2C16H23 |
ABC2D16E23 |
-93.79 |
4.54 |
-8.86 |
0.07 |
0 |
|
|
325698 |
126684554 |
1 |
N5C26H41 |
A5B26C41 |
17.91 |
4.44 |
-8.39 |
0.22 |
0 |
|
|
325699 |
126684560 |
2 |
NOC9H18 |
ABC9D18 |
-102.12 |
4.35 |
-8.66 |
1.92 |
0 |
|
|
325700 |
126684561 |
1 |
ClN4C8H9 |
AB4C8D9 |
70.52 |
5.35 |
-7.87 |
-0.77 |
0 |
|
|
325701 |
126684563 |
2 |
O3N4C11H11 |
A3B4C11D11 |
-162.06 |
4.5 |
-9.08 |
-2.03 |
0 |
|
|
325702 |
126684567 |
1 |
FN2O2C16H23 |
AB2C2D16E23 |
-128.43 |
3.85 |
-9.11 |
0.03 |
0 |
|
|
325703 |
126684573 |
1 |
FN2C17H27 |
AB2C17D27 |
-56.87 |
2.34 |
-8.67 |
0.13 |
0 |
|
|
325704 |
126684574 |
1 |
FON2C16H25 |
ABC2D16E25 |
-85.33 |
0.81 |
-8.8 |
0.05 |
0 |
|
|
325705 |
126684575 |
1 |
ON3C32H49 |
AB3C32D49 |
-60.76 |
2.14 |
-9.02 |
0.36 |
0 |
|
|
325706 |
126684580 |
1 |
N5C26H39 |
A5B26C39 |
14.23 |
0.81 |
-8.69 |
0.01 |
0 |
|
|
325707 |
126684583 |
2 |
NSC6H9 |
ABC6D9 |
19.16 |
1.75 |
-8.95 |
-0.98 |
0 |
|
|
325708 |
126684584 |
1 |
N3C13H21 |
A3B13C21 |
17.74 |
2.3 |
-8.38 |
-0.49 |
0 |
|
|
325709 |
126684587 |
1 |
ClIN3C9H9 |
ABC3D9E9 |
84.62 |
3.81 |
-8.71 |
-1.13 |
0 |
|
|
325710 |
126684589 |
1 |
ON4C20H22 |
AB4C20D22 |
54.5 |
6.96 |
-9.18 |
-0.52 |
0 |
|
|
325711 |
126684597 |
1 |
FNOC15H22 |
ABCD15E22 |
-92.13 |
5.68 |
-9.32 |
0.06 |
0 |
|
|
325712 |
126684603 |
1 |
NO6C17H21 |
AB6C17D21 |
-235.65 |
4.81 |
-9.3 |
-0.98 |
0 |
|
|
325713 |
126684608 |
1 |
NSO6C26H35 |
ABC6D26E35 |
-262.92 |
4.68 |
-8.9 |
-0.96 |
0 |
|
|
325714 |
126684611 |
1 |
FON2C14H21 |
ABC2D14E21 |
-88.64 |
4.8 |
-9.22 |
0.32 |
0 |
|
|
325715 |
126684615 |
1 |
FON2C18H29 |
ABC2D18E29 |
-98.08 |
4.96 |
-8.49 |
0.13 |
0 |
|
|
325716 |
126684616 |
1 |
NC14H23 |
AB14C23 |
-12.43 |
2.13 |
-8.78 |
0.46 |
0 |
|
|
325717 |
126684620 |
1 |
FNOC12H18 |
ABCD12E18 |
-91.95 |
1.85 |
-9.41 |
-0.02 |
0 |
|
|
325718 |
126684624 |
1 |
FOSN2C13H17 |
ABCD2E13F17 |
-77.1 |
5.84 |
-8.48 |
-0.23 |
0 |
|
|
325719 |
126684626 |
2 |
NOC8H12 |
ABC8D12 |
-85.53 |
2.2 |
-8.76 |
0.14 |
0 |
|
|
325720 |
126684628 |
1 |
ON4C19H38 |
AB4C19D38 |
-78.11 |
4.01 |
-8.14 |
1.14 |
0 |
|
|
325721 |
126684631 |
1 |
NO6C24H29 |
AB6C24D29 |
-246.63 |
4.47 |
-8.92 |
-0.9 |
0 |