List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
295950 |
117548506 |
1 |
NO3C12H15 |
AB3C12D15 |
-89.05 |
1.93 |
-10.1 |
-0.44 |
0 |
|
|
295951 |
117548561 |
1 |
ClO3C14H17 |
AB3C14D17 |
-111.6 |
2.61 |
-9.62 |
-0.4 |
0 |
|
|
295952 |
117548575 |
1 |
NO2C11H13 |
AB2C11D13 |
-15.6 |
2.96 |
-9.58 |
0.12 |
0 |
|
|
295953 |
117548597 |
1 |
NOC17H23 |
ABC17D23 |
-9.71 |
3.44 |
-9.38 |
0.14 |
0 |
|
|
295954 |
117548612 |
1 |
FNO2C14H16 |
ABC2D14E16 |
-71.8 |
5.91 |
-9.22 |
-0.5 |
0 |
|
|
295955 |
117548613 |
1 |
NO2C15H19 |
AB2C15D19 |
-34.23 |
3.05 |
-8.8 |
-0.06 |
0 |
|
|
295956 |
117548622 |
1 |
NOC10H17 |
ABC10D17 |
-25.69 |
3.54 |
-9.88 |
1.23 |
0 |
|
|
295957 |
117548628 |
1 |
O3C9H10 |
A3B9C10 |
-73.1 |
3.82 |
-9.69 |
0.0 |
0 |
|
|
295958 |
117548652 |
1 |
O4C13H14 |
A4B13C14 |
-116.8 |
5.28 |
-8.9 |
-0.26 |
0 |
|
|
295959 |
117548659 |
1 |
BrO2C11H11 |
AB2C11D11 |
-40.35 |
5.35 |
-9.84 |
-0.56 |
0 |
|
|
295960 |
117548661 |
1 |
O5C14H18 |
A5B14C18 |
-154.44 |
3.77 |
-8.55 |
-0.22 |
0 |
|
|
295961 |
117548686 |
1 |
O4C13H16 |
A4B13C16 |
-127.43 |
5.43 |
-9.13 |
-0.12 |
0 |
|
|
295962 |
117548689 |
1 |
NO2C11H13 |
AB2C11D13 |
-40.69 |
6.66 |
-9.75 |
-0.55 |
0 |
|
|
295963 |
117548692 |
2 |
OC6H7 |
AB6C7 |
-51.09 |
4.81 |
-9.76 |
-0.05 |
0 |
|
|
295964 |
117548694 |
1 |
O2C13H16 |
A2B13C16 |
-61.26 |
5.13 |
-9.39 |
0.17 |
0 |
|
|
295965 |
117548706 |
1 |
NO2C14H19 |
AB2C14D19 |
-51.61 |
5.72 |
-8.34 |
0.21 |
0 |
|
|
295966 |
117548707 |
1 |
O3C14H18 |
A3B14C18 |
-99.35 |
5.6 |
-9.05 |
-0.02 |
0 |
|
|
295967 |
117548710 |
2 |
O2C7H9 |
A2B7C9 |
-125.64 |
4.59 |
-8.51 |
-0.03 |
0 |
|
|
295968 |
117548718 |
1 |
FO2C12H13 |
AB2C12D13 |
-99.51 |
3.79 |
-9.84 |
-0.33 |
0 |
|
|
295969 |
117548732 |
2 |
OC7H9 |
AB7C9 |
-69.17 |
5.16 |
-9.17 |
0.3 |
0 |
|
|
295970 |
117548737 |
1 |
O3C16H22 |
A3B16C22 |
-110.15 |
5.55 |
-8.81 |
0.09 |
0 |
|
|
295971 |
117548742 |
1 |
O3C11H14 |
A3B11C14 |
-87.51 |
4.25 |
-9.57 |
0.16 |
0 |
|
|
295972 |
117548745 |
1 |
NO2C12H15 |
AB2C12D15 |
-44.84 |
4.59 |
-9.98 |
-0.47 |
0 |
|
|
295973 |
117548783 |
1 |
O2C15H20 |
A2B15C20 |
-74.12 |
4.31 |
-9.18 |
0.24 |
0 |
|
|
295974 |
117548784 |
2 |
OC8H11 |
AB8C11 |
-80.12 |
4.66 |
-9.15 |
0.32 |
0 |
|
|
295975 |
117548792 |
1 |
SO3C10H10 |
AB3C10D10 |
-63.53 |
4.45 |
-9.54 |
-0.83 |
0 |
|
|
295976 |
117548806 |
1 |
ClO3H11C12 |
AB3C11D12 |
-78.98 |
6.23 |
-10.03 |
-0.79 |
0 |
|
|
295977 |
117548839 |
1 |
O3C9H14 |
A3B9C14 |
-113.05 |
4.56 |
-10.16 |
-0.68 |
0 |
|
|
295978 |
117548863 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-42.38 |
4.99 |
-8.32 |
0.14 |
0 |
|
|
295979 |
117548865 |
1 |
NO3C15H21 |
AB3C15D21 |
-90.51 |
3.26 |
-8.88 |
-0.02 |
0 |
|
|
295980 |
117548886 |
1 |
NO3C11H15 |
AB3C11D15 |
-70.94 |
2.36 |
-9.35 |
0.38 |
0 |
|
|
295981 |
117548893 |
1 |
NO2C14H19 |
AB2C14D19 |
-51.07 |
3.88 |
-9.17 |
0.04 |
0 |
|
|
295982 |
117549084 |
1 |
FON2C15H21 |
ABC2D15E21 |
-50.04 |
4.11 |
-8.78 |
-0.19 |
0 |
|
|
295983 |
117549105 |
1 |
FO2C15H19 |
AB2C15D19 |
-113.88 |
4.3 |
-9.78 |
-0.33 |
0 |
|
|
295984 |
117549137 |
1 |
FO2C15H17 |
AB2C15D17 |
-102.09 |
2.83 |
-9.86 |
-0.42 |
0 |
|
|
295985 |
117549157 |
1 |
O2C15H24 |
A2B15C24 |
-98.19 |
5.02 |
-9.64 |
0.75 |
0 |
|
|
295986 |
117549254 |
1 |
NO5C13H15 |
AB5C13D15 |
-157.77 |
5.72 |
-9.2 |
-0.55 |
0 |
|
|
295987 |
117549266 |
1 |
FNO4C12H14 |
ABC4D12E14 |
-169.91 |
6.45 |
-9.57 |
-0.9 |
0 |
|
|
295988 |
117549267 |
1 |
NO4C13H17 |
AB4C13D17 |
-133.56 |
6.12 |
-9.2 |
-0.49 |
0 |
|
|
295989 |
117549275 |
1 |
NO3C8H15 |
AB3C8D15 |
-124.8 |
3.14 |
-10.09 |
0.04 |
0 |
|
|
295990 |
117549311 |
1 |
FNO2C11H14 |
ABC2D11E14 |
-97.19 |
4.04 |
-9.74 |
-0.27 |
0 |
|
|
295991 |
117549344 |
1 |
NO2C11H15 |
AB2C11D15 |
-49.61 |
4.56 |
-9.62 |
-0.18 |
0 |
|
|
295992 |
117549351 |
1 |
NO3C12H17 |
AB3C12D17 |
-91.52 |
4.18 |
-9.17 |
-0.21 |
0 |
|
|
295993 |
117549355 |
1 |
ClNO2C11H14 |
ABC2D11E14 |
-60.41 |
3.47 |
-9.73 |
-0.37 |
0 |
|
|
295994 |
117549468 |
1 |
NO4C14H19 |
AB4C14D19 |
-140.68 |
6.37 |
-9.04 |
-0.19 |
0 |
|
|
295995 |
117549577 |
3 |
OC4H6 |
AB4C6 |
-115.8 |
1.03 |
-9.84 |
0.35 |
0 |
|
|
295996 |
117549626 |
2 |
OC5H9 |
AB5C9 |
-74.64 |
3.79 |
-9.94 |
1.77 |
0 |
|
|
295997 |
117549633 |
1 |
ON2C12H16 |
AB2C12D16 |
21.58 |
4.41 |
-9.32 |
-0.46 |
0 |
|
|
295998 |
117549640 |
1 |
FNOC13H16 |
ABCD13E16 |
-33.45 |
3.18 |
-9.46 |
-0.39 |
0 |
|
|
295999 |
117549686 |
1 |
ON2C13H18 |
AB2C13D18 |
24.51 |
4.12 |
-8.93 |
-0.34 |
0 |