List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
256950 |
103142612 |
1 |
ClO2C16H23 |
AB2C16D23 |
-99.94 |
4.61 |
-8.86 |
0.37 |
0 |
|
|
256951 |
103142620 |
1 |
BrOC14H23 |
ABC14D23 |
-75.78 |
2.65 |
-9.53 |
0.33 |
0 |
|
|
256952 |
103142639 |
1 |
BrOC12H21 |
ABC12D21 |
-86.88 |
2.38 |
-9.54 |
0.36 |
0 |
|
|
256953 |
103142657 |
1 |
NOC16H19 |
ABC16D19 |
-12.26 |
3.73 |
-9.09 |
-0.7 |
0 |
|
|
256954 |
103142660 |
1 |
BrOC11H21 |
ABC11D21 |
-90.12 |
2.29 |
-9.67 |
-0.02 |
0 |
|
|
256955 |
103142670 |
1 |
BrOC16H23 |
ABC16D23 |
-58.38 |
3.0 |
-8.85 |
0.18 |
0 |
|
|
256956 |
103142677 |
1 |
FNOH14C17 |
ABCD14E17 |
-24.62 |
2.3 |
-9.22 |
-0.81 |
0 |
|
|
256957 |
103142700 |
1 |
NOC13H15 |
ABC13D15 |
-15.62 |
1.35 |
-9.12 |
-0.74 |
0 |
|
|
256958 |
103142708 |
1 |
BrClOC14H18 |
ABCD14E18 |
-57.01 |
4.47 |
-9.42 |
-0.17 |
0 |
|
|
256959 |
103142715 |
1 |
ClFOC14H18 |
ABCD14E18 |
-107.13 |
3.68 |
-9.62 |
0.05 |
0 |
|
|
256960 |
103142716 |
1 |
ON2C16H20 |
AB2C16D20 |
-12.09 |
1.24 |
-8.94 |
-0.81 |
0 |
|
|
256961 |
103142719 |
1 |
BrClOC14H18 |
ABCD14E18 |
-56.8 |
5.14 |
-9.52 |
-0.15 |
0 |
|
|
256962 |
103142725 |
1 |
NOC15H19 |
ABC15D19 |
-23.93 |
4.15 |
-9.07 |
-0.66 |
0 |
|
|
256963 |
103142729 |
1 |
BrClOC14H18 |
ABCD14E18 |
-55.08 |
2.22 |
-9.62 |
-0.2 |
0 |
|
|
256964 |
103142749 |
1 |
ClO2C14H23 |
AB2C14D23 |
-112.54 |
2.92 |
-9.59 |
1.04 |
0 |
|
|
256965 |
103142773 |
1 |
N3O4C13H13 |
A3B4C13D13 |
-38.44 |
6.25 |
-9.7 |
-1.79 |
0 |
|
|
256966 |
103142778 |
1 |
NO3H13C17 |
AB3C13D17 |
-33.54 |
1.89 |
-8.94 |
-0.84 |
0 |
|
|
256967 |
103142785 |
3 |
OC3H6 |
AB3C6 |
-163.71 |
3.93 |
-9.68 |
2.22 |
0 |
|
|
256968 |
103142795 |
1 |
O3C15H22 |
A3B15C22 |
-135.48 |
1.31 |
-9.53 |
0.07 |
0 |
|
|
256969 |
103142797 |
1 |
O3C16H24 |
A3B16C24 |
-144.77 |
2.04 |
-9.08 |
0.41 |
0 |
|
|
256970 |
103142802 |
1 |
O3C16H24 |
A3B16C24 |
-145.79 |
1.35 |
-9.41 |
0.18 |
0 |
|
|
256971 |
103142804 |
1 |
ClO3C15H21 |
AB3C15D21 |
-142.9 |
3.87 |
-9.58 |
-0.24 |
0 |
|
|
256972 |
103142836 |
1 |
OCl2C11H20 |
AB2C11D20 |
-109.02 |
3.52 |
-9.86 |
0.84 |
0 |
|
|
256973 |
103142837 |
1 |
NOC17H21 |
ABC17D21 |
-25.89 |
4.26 |
-9.02 |
-0.58 |
0 |
|
|
256974 |
103142843 |
1 |
OCl3C15H19 |
AB3C15D19 |
-75.87 |
0.91 |
-9.57 |
-0.34 |
0 |
|
|
256975 |
103142844 |
1 |
NO2C14H17 |
AB2C14D17 |
-48.71 |
3.0 |
-9.15 |
-0.72 |
0 |
|
|
256976 |
103142848 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-9.41 |
6.24 |
-9.49 |
-1.63 |
0 |
|
|
256977 |
103142858 |
1 |
FOCl2C15H19 |
ABC2D15E19 |
-107.26 |
3.16 |
-9.52 |
-0.1 |
0 |
|
|
256978 |
103142872 |
1 |
NOF3C16H16 |
ABC3D16E16 |
-179.74 |
2.63 |
-9.26 |
-0.81 |
0 |
|
|
256979 |
103142875 |
1 |
OBr2C10H18 |
AB2C10D18 |
-84.07 |
4.71 |
-9.86 |
-0.02 |
0 |
|
|
256980 |
103142877 |
1 |
ClNO2H14C17 |
ABC2D14E17 |
-19.07 |
5.32 |
-9.0 |
-1.01 |
0 |
|
|
256981 |
103142885 |
1 |
N3O3C14H15 |
A3B3C14D15 |
6.51 |
8.22 |
-9.57 |
-1.55 |
0 |
|
|
256982 |
103142887 |
1 |
ON2C18H24 |
AB2C18D24 |
-12.83 |
4.99 |
-8.81 |
-0.61 |
0 |
|
|
256983 |
103142888 |
1 |
N3O3C13H13 |
A3B3C13D13 |
8.07 |
7.59 |
-9.63 |
-1.61 |
0 |
|
|
256984 |
103142895 |
1 |
NOC17H21 |
ABC17D21 |
-25.09 |
4.49 |
-9.03 |
-0.58 |
0 |
|
|
256985 |
103142908 |
1 |
NOC19H19 |
ABC19D19 |
15.19 |
3.72 |
-9.04 |
-0.6 |
0 |
|
|
256986 |
103142909 |
1 |
N3O4C14H15 |
A3B4C14D15 |
-35.22 |
9.26 |
-9.55 |
-1.53 |
0 |
|
|
256987 |
103142913 |
1 |
NO2H17C18 |
AB2C17D18 |
-13.74 |
4.87 |
-9.29 |
-0.88 |
0 |
|
|
256988 |
103142915 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-6.5 |
6.44 |
-9.48 |
-1.63 |
0 |
|
|
256989 |
103142923 |
1 |
ON2C12H12 |
AB2C12D12 |
24.03 |
2.22 |
-9.24 |
-0.8 |
0 |
|
|
256990 |
103142946 |
3 |
NOC5H5 |
ABC5D5 |
10.23 |
9.13 |
-8.95 |
-1.41 |
0 |
|
|
256991 |
103142957 |
1 |
NO2C17H21 |
AB2C17D21 |
-69.54 |
3.43 |
-9.18 |
-0.74 |
0 |
|
|
256992 |
103142961 |
1 |
NOC14H25 |
ABC14D25 |
-66.28 |
3.78 |
-9.02 |
2.33 |
0 |
|
|
256993 |
103142962 |
1 |
NOSC14H15 |
ABCD14E15 |
-10.38 |
3.55 |
-8.99 |
-0.82 |
0 |
|
|
256994 |
103142972 |
1 |
ON4C10H18 |
AB4C10D18 |
-13.2 |
3.89 |
-8.82 |
0.34 |
0 |
|
|
256995 |
103142974 |
1 |
ON4C11H20 |
AB4C11D20 |
-18.73 |
4.72 |
-8.85 |
0.42 |
0 |
|
|
256996 |
103142983 |
1 |
NO2C15H19 |
AB2C15D19 |
-51.99 |
3.1 |
-9.06 |
-0.65 |
0 |
|
|
256997 |
103143001 |
1 |
BrClNOH11C16 |
ABCDE11F16 |
22.75 |
1.75 |
-9.23 |
-0.89 |
0 |
|
|
256998 |
103143002 |
1 |
IN2O3C11H15 |
AB2C3D11E15 |
-113.18 |
2.51 |
-9.34 |
-1.28 |
0 |
|
|
256999 |
103143003 |
1 |
ON2C16H20 |
AB2C16D20 |
-10.09 |
3.07 |
-8.96 |
-0.64 |
0 |