List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
198045 |
79036709 |
1 |
NOSBr2C13H15 |
ABCD2E13F15 |
24.42 |
3.57 |
-9.69 |
-1.37 |
0 |
|
|
198046 |
79037545 |
1 |
BrFON2C12H14 |
ABCD2E12F14 |
-80.34 |
6.85 |
-9.06 |
-0.37 |
0 |
|
|
198047 |
79037562 |
1 |
BrOF2N2C12H13 |
ABC2D2E12F13 |
-120.13 |
3.73 |
-9.51 |
-0.86 |
0 |
|
|
198048 |
79037758 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-116.25 |
1.61 |
-9.46 |
0.48 |
0 |
|
|
198049 |
79037834 |
1 |
N3O4C12H21 |
A3B4C12D21 |
-198.28 |
4.47 |
-9.61 |
0.12 |
0 |
|
|
198050 |
79038245 |
1 |
BrNO2C14H18 |
ABC2D14E18 |
-68.41 |
3.74 |
-9.07 |
-0.08 |
0 |
|
|
198051 |
79038510 |
1 |
ClN3C13H18 |
AB3C13D18 |
43.46 |
3.32 |
-8.49 |
-0.4 |
0 |
|
|
198052 |
79038511 |
1 |
ClSN3C12H14 |
ABC3D12E14 |
49.32 |
1.54 |
-9.01 |
-0.44 |
0 |
|
|
198053 |
79038577 |
1 |
ClN3C14H22 |
AB3C14D22 |
11.9 |
4.78 |
-8.4 |
-0.57 |
0 |
|
|
198054 |
79038578 |
1 |
ClON2C13H17 |
ABC2D13E17 |
59.6 |
4.37 |
-8.94 |
-0.37 |
0 |
|
|
198055 |
79038579 |
1 |
ClN2C15H23 |
AB2C15D23 |
-4.09 |
2.68 |
-8.76 |
-0.32 |
0 |
|
|
198056 |
79039464 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-55.3 |
7.4 |
-8.82 |
-0.45 |
0 |
|
|
198057 |
79039682 |
2 |
NO2C7H12 |
AB2C7D12 |
-208.33 |
4.99 |
-9.34 |
0.64 |
0 |
|
|
198058 |
79040298 |
1 |
ClNOF3H9C13 |
ABCD3E9F13 |
-149.51 |
1.77 |
-9.58 |
-0.77 |
0 |
|
|
198059 |
79040299 |
1 |
NOCl3H8C12 |
ABC3D8E12 |
-2.54 |
2.53 |
-9.68 |
-0.72 |
0 |
|
|
198060 |
79040312 |
1 |
FN3H12C13 |
AB3C12D13 |
32.58 |
4.32 |
-8.84 |
-0.84 |
0 |
|
|
198061 |
79040348 |
1 |
FNS2O4H8C11 |
ABC2D4E8F11 |
-145.88 |
1.19 |
-8.76 |
-1.72 |
0 |
|
|
198062 |
79040349 |
1 |
SO3N4C12H16 |
AB3C4D12E16 |
7.14 |
9.79 |
-9.25 |
-0.88 |
0 |
|
|
198063 |
79040350 |
1 |
ON5C11H15 |
AB5C11D15 |
58.1 |
3.79 |
-10.29 |
-1.12 |
0 |
|
|
198064 |
79040351 |
1 |
ClFOH5N5C10 |
ABCD5E5F10 |
61.94 |
2.83 |
-10.18 |
-1.76 |
0 |
|
|
198065 |
79040450 |
2 |
NO2C7H10 |
AB2C7D10 |
-91.91 |
3.18 |
-9.66 |
-1.36 |
0 |
|
|
198066 |
79041816 |
1 |
O2N3C14H15 |
A2B3C14D15 |
-30.84 |
6.02 |
-8.57 |
-0.66 |
0 |
|
|
198067 |
79042037 |
1 |
SO2N3C13H15 |
AB2C3D13E15 |
-33.71 |
3.39 |
-8.65 |
-0.12 |
0 |
|
|
198068 |
79042114 |
1 |
ON3C14H15 |
AB3C14D15 |
-1.49 |
5.86 |
-8.81 |
-0.22 |
0 |
|
|
198069 |
79042324 |
1 |
OF2N3H11C13 |
AB2C3D11E13 |
-84.94 |
2.64 |
-9.12 |
-0.94 |
0 |
|
|
198070 |
79042615 |
1 |
N2O2C13H18 |
A2B2C13D18 |
-77.03 |
6.19 |
-8.9 |
-0.47 |
0 |
|
|
198071 |
79042841 |
1 |
N2O4H10C15 |
A2B4C10D15 |
-91.04 |
3.78 |
-9.71 |
-2.2 |
0 |
|
|
198072 |
79043388 |
1 |
SN4C15H16 |
AB4C15D16 |
61.64 |
5.28 |
-8.6 |
-0.83 |
0 |
|
|
198073 |
79043646 |
1 |
BrFON2H10C13 |
ABCD2E10F13 |
-33.81 |
3.69 |
-9.56 |
-1.06 |
0 |
|
|
198074 |
79043892 |
1 |
ON3C15H17 |
AB3C15D17 |
2.14 |
3.67 |
-8.99 |
-0.22 |
0 |
|
|
198075 |
79043987 |
1 |
ClSN3H12C13 |
ABC3D12E13 |
53.32 |
3.25 |
-8.75 |
-0.88 |
0 |
|
|
198076 |
79043988 |
1 |
N2O2C11H18 |
A2B2C11D18 |
-104.5 |
4.2 |
-8.93 |
0.04 |
0 |
|
|
198077 |
79043989 |
1 |
N2O3C10H16 |
A2B3C10D16 |
-126.26 |
3.63 |
-9.08 |
-0.36 |
0 |
|
|
198078 |
79044001 |
1 |
SO2N4C13H14 |
AB2C4D13E14 |
13.0 |
4.47 |
-9.4 |
-1.09 |
0 |
|
|
198079 |
79044688 |
1 |
BrClFN2H13C16 |
ABCD2E13F16 |
1.32 |
4.95 |
-9.24 |
-0.93 |
0 |
|
|
198080 |
79044689 |
1 |
ClF2N2H13C16 |
AB2C2D13E16 |
-48.4 |
4.98 |
-9.25 |
-0.93 |
0 |
|
|
198081 |
79044771 |
1 |
FON4C15H19 |
ABC4D15E19 |
-56.7 |
3.82 |
-8.91 |
0.07 |
0 |
|
|
198082 |
79044876 |
1 |
N2C13H28 |
A2B13C28 |
-35.06 |
0.41 |
-8.22 |
2.73 |
0 |
|
|
198083 |
79044887 |
1 |
NO2C15H27 |
AB2C15D27 |
-115.28 |
3.26 |
-8.79 |
0.54 |
0 |
|
|
198084 |
79045238 |
1 |
NOC17H27 |
ABC17D27 |
-61.68 |
3.76 |
-8.8 |
0.62 |
0 |
|
|
198085 |
79045521 |
1 |
NO2C16H25 |
AB2C16D25 |
-91.8 |
4.32 |
-8.72 |
0.29 |
0 |
|
|
198086 |
79045522 |
1 |
NO3C12H19 |
AB3C12D19 |
-108.23 |
1.5 |
-8.83 |
0.48 |
0 |
|
|
198087 |
79045523 |
1 |
FNO2C15H22 |
ABC2D15E22 |
-128.74 |
2.59 |
-8.95 |
0.07 |
0 |
|
|
198088 |
79045524 |
1 |
SN2O2C14H30 |
AB2C2D14E30 |
-118.26 |
7.22 |
-8.7 |
1.23 |
0 |
|
|
198089 |
79045525 |
1 |
ON2C15H26 |
AB2C15D26 |
-36.26 |
2.58 |
-8.81 |
0.83 |
0 |
|
|
198090 |
79045526 |
2 |
NC7H14 |
AB7C14 |
-13.76 |
2.56 |
-8.54 |
2.57 |
0 |
|
|
198091 |
79045527 |
1 |
SN2C15H26 |
AB2C15D26 |
6.45 |
2.27 |
-8.32 |
0.25 |
0 |
|
|
198092 |
79045528 |
1 |
NOSC15H23 |
ABCD15E23 |
-35.18 |
4.28 |
-8.75 |
-0.1 |
0 |
|
|
198093 |
79045529 |
1 |
FNO2C16H22 |
ABC2D16E22 |
-116.01 |
1.21 |
-8.82 |
-0.43 |
0 |
|
|
198094 |
79045530 |
1 |
FNOC16H22 |
ABCD16E22 |
-86.38 |
1.89 |
-8.86 |
0.06 |
0 |