List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
272700 |
103752014 |
1 |
BrON4C14H21 |
ABC4D14E21 |
-21.79 |
2.75 |
-8.35 |
-1.04 |
0 |
|
|
272701 |
103752034 |
1 |
BrON4C12H13 |
ABC4D12E13 |
19.45 |
5.93 |
-8.92 |
-1.37 |
0 |
|
|
272702 |
103752097 |
1 |
BrFON2H12C14 |
ABCD2E12F14 |
-44.88 |
2.77 |
-9.59 |
-0.92 |
0 |
|
|
272703 |
103752182 |
1 |
BrN2O2F3H8C13 |
AB2C2D3E8F13 |
-189.89 |
1.08 |
-9.59 |
-1.35 |
0 |
|
|
272704 |
103752251 |
1 |
BrON5H12C14 |
ABC5D12E14 |
58.05 |
4.78 |
-9.44 |
-1.02 |
0 |
|
|
272705 |
103752254 |
1 |
BrFO2N3H11C14 |
ABC2D3E11F14 |
-83.5 |
3.08 |
-8.81 |
-1.18 |
0 |
|
|
272706 |
103752258 |
1 |
BrON2H15C16 |
ABC2D15E16 |
22.69 |
2.86 |
-9.73 |
-1.07 |
0 |
|
|
272707 |
103752319 |
1 |
BrON4H11C15 |
ABC4D11E15 |
52.19 |
2.59 |
-9.34 |
-1.4 |
0 |
|
|
272708 |
103752320 |
1 |
BrON2C9H11 |
ABC2D9E11 |
-18.93 |
5.03 |
-9.79 |
-0.78 |
0 |
|
|
272709 |
103752443 |
1 |
BrN3O3C14H18 |
AB3C3D14E18 |
-117.47 |
4.93 |
-9.8 |
-0.76 |
0 |
|
|
272710 |
103752543 |
1 |
BrON3C15H22 |
ABC3D15E22 |
-35.19 |
4.55 |
-8.72 |
-0.9 |
0 |
|
|
272711 |
103752603 |
1 |
BrN2O2C12H15 |
AB2C2D12E15 |
-62.35 |
3.5 |
-9.72 |
-0.85 |
0 |
|
|
272712 |
103752630 |
1 |
BrN2O3C11H13 |
AB2C3D11E13 |
-116.35 |
4.56 |
-10.05 |
-1.2 |
0 |
|
|
272713 |
103752676 |
1 |
BrON2C15H15 |
ABC2D15E15 |
-3.31 |
4.93 |
-9.52 |
-0.82 |
0 |
|
|
272714 |
103752677 |
1 |
BrON2C15H15 |
ABC2D15E15 |
-7.48 |
3.59 |
-9.41 |
-1.0 |
0 |
|
|
272715 |
103752678 |
1 |
BrON2C14H17 |
ABC2D14E17 |
-30.09 |
4.0 |
-9.31 |
-0.9 |
0 |
|
|
272716 |
103752685 |
1 |
BrON2C16H17 |
ABC2D16E17 |
-13.7 |
3.46 |
-9.33 |
-1.02 |
0 |
|
|
272717 |
103752947 |
1 |
N2O3C17H26 |
A2B3C17D26 |
-142.02 |
3.77 |
-8.94 |
-0.05 |
0 |
|
|
272718 |
103752976 |
2 |
BrNC7H10 |
ABC7D10 |
41.75 |
4.72 |
-8.9 |
-0.47 |
0 |
|
|
272719 |
103752979 |
1 |
Br2N3C13H15 |
A2B3C13D15 |
64.54 |
3.58 |
-9.15 |
-0.6 |
0 |
|
|
272720 |
103753080 |
1 |
N3C14H25 |
A3B14C25 |
3.75 |
1.73 |
-8.7 |
0.96 |
0 |
|
|
272721 |
103753135 |
1 |
ON3C12H21 |
AB3C12D21 |
-25.86 |
4.49 |
-9.37 |
0.83 |
0 |
|
|
272722 |
103753138 |
1 |
BrNOSC12H18 |
ABCDE12F18 |
-36.51 |
2.72 |
-9.18 |
-0.5 |
0 |
|
|
272723 |
103753163 |
1 |
OSN2C12H20 |
ABC2D12E20 |
-39.52 |
2.71 |
-9.15 |
-0.43 |
0 |
|
|
272724 |
103753300 |
1 |
IN2O3C15H19 |
AB2C3D15E19 |
-33.75 |
5.72 |
-10.02 |
-1.85 |
0 |
|
|
272725 |
103753365 |
1 |
BrFOSN2H8C11 |
ABCDE2F8G11 |
-32.3 |
4.51 |
-9.49 |
-0.98 |
0 |
|
|
272726 |
103753468 |
1 |
FNOSBr2H6C11 |
ABCDE2F6G11 |
-24.97 |
3.81 |
-9.38 |
-1.2 |
0 |
|
|
272727 |
103753492 |
1 |
BrFON2H14C15 |
ABCD2E14F15 |
-41.32 |
5.95 |
-8.56 |
-0.51 |
0 |
|
|
272728 |
103753510 |
1 |
BrFNO2H13C16 |
ABCD2E13F16 |
-88.92 |
2.99 |
-9.03 |
-0.7 |
0 |
|
|
272729 |
103753568 |
1 |
BrFNOSH11C15 |
ABCDEF11G15 |
-44.01 |
3.29 |
-8.82 |
-0.59 |
0 |
|
|
272730 |
103753673 |
1 |
BrFNOSH11C14 |
ABCDEF11G14 |
-42.01 |
4.61 |
-8.98 |
-0.69 |
0 |
|
|
272731 |
103753715 |
1 |
N3C13H21 |
A3B13C21 |
-1.31 |
1.83 |
-8.82 |
0.11 |
0 |
|
|
272732 |
103753716 |
1 |
ON4C13H20 |
AB4C13D20 |
-21.63 |
6.56 |
-8.99 |
-0.6 |
0 |
|
|
272733 |
103753718 |
1 |
O2N5C13H21 |
A2B5C13D21 |
-11.17 |
1.94 |
-9.48 |
-1.0 |
0 |
|
|
272734 |
103753758 |
1 |
N5C14H21 |
A5B14C21 |
45.6 |
3.14 |
-8.53 |
-0.43 |
0 |
|
|
272735 |
103753759 |
1 |
N3C14H19 |
A3B14C19 |
37.5 |
8.91 |
-8.82 |
-0.61 |
0 |
|
|
272736 |
103753760 |
2 |
ON2C7H12 |
AB2C7D12 |
-111.98 |
6.11 |
-9.06 |
-0.17 |
0 |
|
|
272737 |
103753784 |
1 |
NSO3C16H23 |
ABC3D16E23 |
-121.48 |
4.05 |
-9.87 |
-1.11 |
0 |
|
|
272738 |
103753871 |
1 |
BrClFON2H11C14 |
ABCDE2F11G14 |
-40.37 |
5.08 |
-9.87 |
-0.81 |
0 |
|
|
272739 |
103753901 |
1 |
BrON3C12H18 |
ABC3D12E18 |
-27.16 |
6.39 |
-9.14 |
-0.74 |
0 |
|
|
272740 |
103753902 |
1 |
BrON3C12H18 |
ABC3D12E18 |
-30.2 |
2.31 |
-8.9 |
-0.97 |
0 |
|
|
272741 |
103753907 |
1 |
BrON2C16H17 |
ABC2D16E17 |
-14.46 |
4.28 |
-9.1 |
-0.84 |
0 |
|
|
272742 |
103753919 |
1 |
BrN2O2C15H15 |
AB2C2D15E15 |
-37.35 |
4.09 |
-8.88 |
-1.01 |
0 |
|
|
272743 |
103753920 |
2 |
NOC8H10 |
ABC8D10 |
-38.46 |
1.67 |
-9.36 |
0.1 |
0 |
|
|
272744 |
103753953 |
1 |
BrON3C15H22 |
ABC3D15E22 |
-36.11 |
4.71 |
-8.77 |
-0.86 |
0 |
|
|
272745 |
103754147 |
1 |
BrO2N3C15H20 |
AB2C3D15E20 |
-73.32 |
6.1 |
-9.35 |
-1.09 |
0 |
|
|
272746 |
103754281 |
1 |
BrN3O3H12C14 |
AB3C3D12E14 |
0.07 |
7.37 |
-9.56 |
-1.35 |
0 |
|
|
272747 |
103754414 |
1 |
BrO2N3C12H12 |
AB2C3D12E12 |
1.63 |
3.25 |
-9.99 |
-0.88 |
0 |
|
|
272748 |
103754415 |
1 |
BrFO2N3H9C13 |
ABC2D3E9F13 |
-72.0 |
5.77 |
-9.52 |
-1.34 |
0 |
|
|
272749 |
103754626 |
1 |
BrN2O2C11H15 |
AB2C2D11E15 |
-63.09 |
3.76 |
-9.26 |
-0.93 |
0 |