List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
425693 |
135127411 |
1 |
N4O4C23H24 |
A4B4C23D24 |
-108.36 |
8.66 |
-8.78 |
-0.73 |
0 |
|
|
425694 |
135127413 |
1 |
INOC7H8 |
ABCD7E8 |
-1.11 |
2.81 |
-8.36 |
-1.65 |
0 |
|
|
425695 |
135127421 |
1 |
O2C17H18 |
A2B17C18 |
14.51 |
2.13 |
-9.24 |
-0.76 |
0 |
|
|
425696 |
135127422 |
1 |
NO2C16H25 |
AB2C16D25 |
-79.77 |
5.73 |
-8.47 |
-0.27 |
0 |
|
|
425697 |
135127423 |
1 |
OSN2C21H26 |
ABC2D21E26 |
-13.03 |
2.91 |
-8.1 |
-0.13 |
0 |
|
|
425698 |
135127424 |
1 |
INC15H28 |
ABC15D28 |
-21.44 |
1.02 |
-8.2 |
-0.73 |
0 |
|
|
425699 |
135127425 |
1 |
NSO3C21H25 |
ABC3D21E25 |
-95.04 |
2.53 |
-8.12 |
-0.26 |
0 |
|
|
425700 |
135127478 |
1 |
FCl3N3O6C31H31 |
AB3C3D6E31F31 |
-273.02 |
7.27 |
-9.63 |
-1.48 |
0 |
|
|
425701 |
135127479 |
1 |
FSC7H11 |
ABC7D11 |
-37.92 |
3.97 |
-8.7 |
-0.94 |
0 |
|
|
425702 |
135127489 |
1 |
OF3C12H15 |
AB3C12D15 |
-207.21 |
2.88 |
-9.0 |
-0.02 |
0 |
|
|
425703 |
135127499 |
1 |
FSN3C13H22 |
ABC3D13E22 |
-15.34 |
3.19 |
-8.39 |
0.28 |
0 |
|
|
425704 |
135127501 |
1 |
O2N3C35H35 |
A2B3C35D35 |
182.97 |
3.74 |
-9.16 |
-1.36 |
0 |
|
|
425705 |
135127502 |
1 |
NOSC24H49 |
ABCD24E49 |
-159.87 |
2.28 |
-9.07 |
0.15 |
0 |
|
|
425706 |
135127503 |
1 |
NO6C24H45 |
AB6C24D45 |
-323.21 |
7.05 |
-9.85 |
0.46 |
0 |
|
|
425707 |
135127505 |
1 |
NC11H17 |
AB11C17 |
39.7 |
2.47 |
-8.56 |
-0.28 |
0 |
|
|
425708 |
135127506 |
1 |
NO2C11H23 |
AB2C11D23 |
-148.87 |
2.18 |
-9.83 |
1.01 |
0 |
|
|
425709 |
135127507 |
2 |
NC3H7 |
AB3C7 |
8.44 |
2.26 |
-8.96 |
2.35 |
0 |
|
|
425710 |
135127510 |
1 |
NC11H19 |
AB11C19 |
1.12 |
2.11 |
-9.21 |
0.36 |
0 |
|
|
425711 |
135127512 |
1 |
SC11H16 |
AB11C16 |
-6.55 |
2.4 |
-8.9 |
0.02 |
0 |
|
|
425712 |
135127514 |
1 |
F3O3N4C30H33 |
A3B3C4D30E33 |
-232.14 |
7.24 |
-8.99 |
-1.13 |
0 |
|
|
425713 |
135127523 |
1 |
NOSC10H21 |
ABCD10E21 |
-99.64 |
1.59 |
-9.06 |
0.12 |
0 |
|
|
425714 |
135127527 |
2 |
NC12H15 |
AB12C15 |
35.15 |
0.6 |
-7.66 |
0.21 |
0 |
|
|
425715 |
135127578 |
1 |
NSF3O4H26C30 |
ABC3D4E26F30 |
-240.85 |
2.02 |
-8.86 |
-0.87 |
0 |
|
|
425716 |
135127584 |
1 |
OC11H20 |
AB11C20 |
-54.7 |
1.61 |
-9.18 |
0.94 |
0 |
|
|
425717 |
135127596 |
1 |
S3C23H30 |
A3B23C30 |
16.85 |
2.04 |
-8.56 |
-0.04 |
0 |
|
|
425718 |
135127599 |
1 |
NO2H19C30 |
AB2C19D30 |
68.85 |
4.58 |
-8.38 |
-1.17 |
0 |
|
|
425719 |
135127601 |
1 |
ClFNSO4H31C32 |
ABCDE4F31G32 |
-118.24 |
2.46 |
-9.07 |
-0.7 |
0 |
|
|
425720 |
135127604 |
1 |
NO3C8H9 |
AB3C8D9 |
-71.94 |
7.54 |
-9.56 |
-0.57 |
0 |
|
|
425721 |
135127606 |
2 |
NO2C12H15 |
AB2C12D15 |
-149.58 |
4.43 |
-8.52 |
-0.11 |
0 |
|
|
425722 |
135127607 |
1 |
OH16C19 |
AB16C19 |
55.69 |
1.61 |
-8.9 |
-0.57 |
0 |
|
|
425723 |
135127610 |
1 |
NSO7C22H33 |
ABC7D22E33 |
-261.51 |
3.85 |
-8.79 |
-0.59 |
0 |
|
|
425724 |
135127611 |
1 |
NO2H19C21 |
AB2C19D21 |
-4.77 |
3.48 |
-8.0 |
-0.6 |
0 |
|
|
425725 |
135127614 |
1 |
Cl2N2O2H18C25 |
A2B2C2D18E25 |
-2.69 |
8.05 |
-8.06 |
-0.93 |
0 |
|
|
425726 |
135127615 |
1 |
ClNO2H14C19 |
ABC2D14E19 |
-16.25 |
5.42 |
-8.44 |
-1.05 |
0 |
|
|
425727 |
135127616 |
1 |
NO2H13C19 |
AB2C13D19 |
-4.4 |
5.07 |
-8.26 |
-1.05 |
0 |
|
|
425728 |
135127641 |
2 |
NOC6H11 |
ABC6D11 |
-117.1 |
3.41 |
-9.12 |
1.24 |
0 |
|
|
425729 |
135127642 |
1 |
NO4C18H29 |
AB4C18D29 |
-161.18 |
1.99 |
-10.08 |
-0.09 |
0 |
|
|
425730 |
135127656 |
1 |
INO3C13H24 |
ABC3D13E24 |
-169.63 |
0.99 |
-9.6 |
-0.92 |
0 |
|
|
425731 |
135127662 |
1 |
FON2C13H19 |
ABC2D13E19 |
-73.9 |
2.62 |
-8.97 |
-0.44 |
0 |
|
|
425732 |
135127685 |
1 |
N2O2C25H32 |
A2B2C25D32 |
-30.5 |
5.17 |
-8.29 |
-0.4 |
0 |
|
|
425733 |
135127687 |
1 |
SN2O2C21H24 |
AB2C2D21E24 |
-6.08 |
6.43 |
-8.38 |
-0.54 |
0 |
|
|
425734 |
135127690 |
1 |
F2O3N6C23H24 |
A2B3C6D23E24 |
-63.11 |
4.42 |
-8.98 |
-0.64 |
0 |
|
|
425735 |
135127693 |
1 |
N2C13H20 |
A2B13C20 |
8.35 |
0.92 |
-7.66 |
0.33 |
0 |
|
|
425736 |
135127695 |
1 |
F2O3N4C23H28 |
A2B3C4D23E28 |
-125.89 |
3.16 |
-8.22 |
-0.54 |
0 |
|
|
425737 |
135127696 |
1 |
F2O3N6C24H26 |
A2B3C6D24E26 |
-75.91 |
6.45 |
-8.91 |
-0.77 |
0 |
|
|
425738 |
135127697 |
1 |
ON6C15H18 |
AB6C15D18 |
86.43 |
6.02 |
-8.77 |
-0.23 |
0 |
|
|
425739 |
135127699 |
2 |
FON3C12H14 |
ABC3D12E14 |
-21.58 |
5.35 |
-8.73 |
-0.77 |
0 |
|
|
425740 |
135127702 |
1 |
ON3C17H25 |
AB3C17D25 |
-2.01 |
3.72 |
-8.25 |
-0.24 |
0 |
|
|
425741 |
135127703 |
1 |
ON3C14H19 |
AB3C14D19 |
17.84 |
5.28 |
-8.35 |
-0.19 |
0 |
|
|
425742 |
135127707 |
1 |
FN4H19C20 |
AB4C19D20 |
58.11 |
3.62 |
-8.79 |
-0.8 |
0 |
|
|
425743 |
135127713 |
1 |
F2N4H20C23 |
A2B4C20D23 |
-8.44 |
6.66 |
-8.87 |
-1.12 |
0 |
|
|
425744 |
135127721 |
1 |
ClFON3H23C24 |
ABCD3E23F24 |
-2.59 |
5.6 |
-8.77 |
-0.5 |
0 |
|
|
425745 |
135127774 |
1 |
ClN3H18C23 |
AB3C18D23 |
116.71 |
4.07 |
-9.22 |
-1.48 |
0 |
|
|
425746 |
135127782 |
1 |
F2O2N5C25H25 |
A2B2C5D25E25 |
-64.13 |
8.3 |
-8.56 |
-1.06 |
0 |
|
|
425747 |
135127784 |
1 |
FON4H21C26 |
ABC4D21E26 |
51.19 |
3.92 |
-8.8 |
-1.14 |
0 |
|
|
425748 |
135127785 |
1 |
ON3C28H31 |
AB3C28D31 |
84.99 |
7.76 |
-8.52 |
-0.45 |
0 |
|
|
425749 |
135127786 |
1 |
ON4H22C25 |
AB4C22D25 |
85.57 |
4.5 |
-8.68 |
-1.08 |
0 |
|
|
425750 |
135127787 |
1 |
ClF2O2N3H20C23 |
AB2C2D3E20F23 |
-86.49 |
1.87 |
-8.9 |
-0.82 |
0 |
|
|
425751 |
135127795 |
1 |
ClFN5C27H37 |
ABC5D27E37 |
7.88 |
7.04 |
-8.11 |
0.04 |
0 |
|
|
425752 |
135127796 |
1 |
ClFO2N5C27H47 |
ABC2D5E27F47 |
-146.23 |
6.41 |
-8.8 |
0.78 |
0 |
|
|
425753 |
135127797 |
1 |
ClON4H19C21 |
ABC4D19E21 |
79.78 |
3.45 |
-8.4 |
-0.96 |
0 |
|
|
425754 |
135127798 |
1 |
ClFON5C25H35 |
ABCD5E25F35 |
-46.3 |
9.63 |
-9.02 |
-0.16 |
0 |
|
|
425755 |
135127839 |
1 |
ClFN5C24H27 |
ABC5D24E27 |
31.78 |
7.92 |
-8.06 |
-0.48 |
0 |
|
|
425756 |
135127841 |
1 |
ClN5C24H24 |
AB5C24D24 |
136.8 |
6.69 |
-8.43 |
-0.39 |
0 |
|
|
425757 |
135127845 |
1 |
O3N4H18C22 |
A3B4C18D22 |
12.12 |
2.63 |
-8.79 |
-1.12 |
0 |
|
|
425758 |
135127846 |
1 |
ClO2N5H24C29 |
AB2C5D24E29 |
44.73 |
1.18 |
-8.44 |
-1.06 |
0 |
|
|
425759 |
135127876 |
1 |
ClFON4H12C20 |
ABCD4E12F20 |
37.78 |
2.49 |
-9.25 |
-1.68 |
0 |
|
|
425760 |
135127883 |
1 |
O2N5H29C32 |
A2B5C29D32 |
75.89 |
6.78 |
-8.73 |
-1.04 |
0 |
|
|
425761 |
135127884 |
1 |
O3N5C28H31 |
A3B5C28D31 |
4.92 |
4.5 |
-8.55 |
-1.16 |
0 |
|
|
425762 |
135127886 |
1 |
F4N4H16C25 |
A4B4C16D25 |
-46.45 |
1.91 |
-8.02 |
-1.14 |
0 |
|
|
425763 |
135127888 |
1 |
ON4H22C23 |
AB4C22D23 |
75.24 |
3.96 |
-8.23 |
-0.9 |
0 |
|
|
425764 |
135127890 |
1 |
ClON4H15C21 |
ABC4D15E21 |
167.15 |
6.95 |
-7.87 |
-1.38 |
0 |
|
|
425765 |
135127893 |
1 |
ClNOC13H16 |
ABCD13E16 |
-2.35 |
2.9 |
-8.94 |
-0.34 |
0 |
|
|
425766 |
135127899 |
1 |
OF3N5H18C25 |
AB3C5D18E25 |
-22.0 |
6.0 |
-8.88 |
-1.64 |
0 |
|
|
425767 |
135127900 |
1 |
O2N6C29H32 |
A2B6C29D32 |
13.29 |
5.9 |
-8.75 |
-1.3 |
0 |