List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
265950 |
103556981 |
1 |
ClN2O2C15H17 |
AB2C2D15E17 |
-14.62 |
3.18 |
-9.06 |
-0.41 |
0 |
|
|
265951 |
103556983 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-4.1 |
4.04 |
-8.93 |
-0.14 |
0 |
|
|
265952 |
103556984 |
1 |
BrN2O2C15H17 |
AB2C2D15E17 |
-2.62 |
3.16 |
-8.98 |
-0.42 |
0 |
|
|
265953 |
103556986 |
1 |
FN2O2C15H17 |
AB2C2D15E17 |
-51.08 |
1.2 |
-9.05 |
-0.22 |
0 |
|
|
265954 |
103556992 |
1 |
N2O2C9H14 |
A2B2C9D14 |
-27.54 |
2.97 |
-9.26 |
0.24 |
0 |
|
|
265955 |
103556997 |
1 |
FN2O2C15H17 |
AB2C2D15E17 |
-50.93 |
5.0 |
-9.04 |
-0.36 |
0 |
|
|
265956 |
103557011 |
1 |
ClFN2O2C15H16 |
ABC2D2E15F16 |
-58.94 |
2.91 |
-9.1 |
-0.57 |
0 |
|
|
265957 |
103557018 |
1 |
ClO2C7H11 |
AB2C7D11 |
-96.16 |
3.16 |
-10.36 |
-0.28 |
0 |
|
|
265958 |
103557025 |
1 |
NO2C14H19 |
AB2C14D19 |
-64.46 |
1.49 |
-9.4 |
-0.05 |
0 |
|
|
265959 |
103557031 |
1 |
ON2C17H22 |
AB2C17D22 |
-6.03 |
3.2 |
-9.16 |
-0.71 |
0 |
|
|
265960 |
103557046 |
1 |
ON2C14H22 |
AB2C14D22 |
-23.86 |
3.16 |
-9.28 |
0.34 |
0 |
|
|
265961 |
103557047 |
1 |
ON2C15H24 |
AB2C15D24 |
-22.52 |
4.36 |
-8.92 |
-0.11 |
0 |
|
|
265962 |
103557049 |
1 |
ON2C17H28 |
AB2C17D28 |
-32.8 |
3.14 |
-8.76 |
-0.19 |
0 |
|
|
265963 |
103557063 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-63.11 |
3.09 |
-8.81 |
-0.38 |
0 |
|
|
265964 |
103557064 |
1 |
ClN2O2C9H13 |
AB2C2D9E13 |
-30.78 |
3.41 |
-10.2 |
-0.6 |
0 |
|
|
265965 |
103557069 |
1 |
N2O3C10H16 |
A2B3C10D16 |
-74.43 |
3.19 |
-10.15 |
-0.36 |
0 |
|
|
265966 |
103557131 |
1 |
ON2C14H18 |
AB2C14D18 |
-7.64 |
2.05 |
-8.64 |
0.13 |
0 |
|
|
265967 |
103557133 |
1 |
BrON2C13H15 |
ABC2D13E15 |
2.42 |
3.57 |
-9.12 |
-0.55 |
0 |
|
|
265968 |
103557134 |
2 |
NOC7H9 |
ABC7D9 |
-40.47 |
1.0 |
-8.46 |
-0.12 |
0 |
|
|
265969 |
103557137 |
1 |
ON3C13H17 |
AB3C13D17 |
8.75 |
4.5 |
-8.98 |
-0.29 |
0 |
|
|
265970 |
103557138 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-34.57 |
2.49 |
-8.73 |
-0.47 |
0 |
|
|
265971 |
103557139 |
1 |
ON4C14H20 |
AB4C14D20 |
13.35 |
4.51 |
-8.16 |
-0.16 |
0 |
|
|
265972 |
103557158 |
1 |
N2O3C14H16 |
A2B3C14D16 |
-81.18 |
4.62 |
-9.61 |
-1.06 |
0 |
|
|
265973 |
103557159 |
1 |
N2O3C15H18 |
A2B3C15D18 |
-85.02 |
9.63 |
-9.33 |
-0.67 |
0 |
|
|
265974 |
103557160 |
1 |
N2O3C15H18 |
A2B3C15D18 |
-83.8 |
5.4 |
-9.11 |
-0.51 |
0 |
|
|
265975 |
103557209 |
1 |
NO3C17H29 |
AB3C17D29 |
-165.48 |
5.68 |
-9.24 |
1.28 |
0 |
|
|
265976 |
103557210 |
1 |
NO3C16H29 |
AB3C16D29 |
-166.32 |
4.47 |
-9.34 |
1.13 |
0 |
|
|
265977 |
103557409 |
2 |
NOC6H11 |
ABC6D11 |
-99.1 |
4.71 |
-9.35 |
0.97 |
0 |
|
|
265978 |
103557435 |
1 |
NO3C17H21 |
AB3C17D21 |
-62.27 |
3.41 |
-9.62 |
-0.58 |
0 |
|
|
265979 |
103557490 |
1 |
BrO3C14H19 |
AB3C14D19 |
-109.74 |
3.51 |
-8.86 |
-0.12 |
0 |
|
|
265980 |
103557491 |
1 |
BrO3C14H19 |
AB3C14D19 |
-109.06 |
5.37 |
-9.07 |
-0.24 |
0 |
|
|
265981 |
103557492 |
1 |
O2C15H22 |
A2B15C22 |
-90.67 |
1.85 |
-8.85 |
0.56 |
0 |
|
|
265982 |
103557499 |
1 |
BrO2C13H17 |
AB2C13D17 |
-69.04 |
1.49 |
-9.7 |
-0.42 |
0 |
|
|
265983 |
103557513 |
1 |
O2C15H22 |
A2B15C22 |
-89.32 |
1.8 |
-8.95 |
0.5 |
0 |
|
|
265984 |
103557514 |
1 |
O5C16H24 |
A5B16C24 |
-194.72 |
0.82 |
-8.89 |
0.45 |
0 |
|
|
265985 |
103557515 |
1 |
O2C17H26 |
A2B17C26 |
-93.43 |
2.44 |
-9.1 |
0.44 |
0 |
|
|
265986 |
103557517 |
1 |
O4C15H20 |
A4B15C20 |
-145.66 |
4.23 |
-8.77 |
-0.04 |
0 |
|
|
265987 |
103557521 |
1 |
O4C15H22 |
A4B15C22 |
-155.64 |
5.85 |
-8.76 |
0.18 |
0 |
|
|
265988 |
103557523 |
1 |
NO3C16H21 |
AB3C16D21 |
-124.28 |
4.14 |
-8.8 |
-0.14 |
0 |
|
|
265989 |
103557525 |
1 |
F2O2C13H16 |
A2B2C13D16 |
-165.41 |
1.42 |
-9.93 |
-0.6 |
0 |
|
|
265990 |
103557526 |
2 |
OC8H12 |
AB8C12 |
-98.16 |
2.24 |
-9.12 |
0.38 |
0 |
|
|
265991 |
103557529 |
1 |
O2C19H30 |
A2B19C30 |
-109.62 |
3.87 |
-8.98 |
0.51 |
0 |
|
|
265992 |
103557530 |
1 |
NO3C15H19 |
AB3C15D19 |
-113.51 |
0.94 |
-9.13 |
-0.44 |
0 |
|
|
265993 |
103557531 |
2 |
OC8H12 |
AB8C12 |
-91.7 |
2.27 |
-9.26 |
0.26 |
0 |
|
|
265994 |
103557532 |
1 |
O2C19H28 |
A2B19C28 |
-93.98 |
2.5 |
-9.11 |
0.41 |
0 |
|
|
265995 |
103557534 |
1 |
NO3C16H21 |
AB3C16D21 |
-115.64 |
4.94 |
-8.58 |
-0.01 |
0 |
|
|
265996 |
103557539 |
2 |
NOC8H10 |
ABC8D10 |
-24.69 |
4.54 |
-8.96 |
-0.38 |
0 |
|
|
265997 |
103557546 |
1 |
Cl2O2C13H16 |
A2B2C13D16 |
-86.62 |
3.75 |
-9.43 |
-0.41 |
0 |
|
|
265998 |
103557554 |
1 |
BrO3C15H21 |
AB3C15D21 |
-118.76 |
4.8 |
-8.92 |
-0.08 |
0 |
|
|
265999 |
103557555 |
1 |
O3C15H22 |
A3B15C22 |
-120.16 |
3.82 |
-8.64 |
0.26 |
0 |