List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
350010 |
127276883 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-121.47 |
2.33 |
-8.75 |
0.35 |
0 |
|
|
350011 |
127276884 |
1 |
N3O3C22H23 |
A3B3C22D23 |
-2.7 |
7.0 |
-9.02 |
-0.98 |
0 |
|
|
350012 |
127276885 |
1 |
ON3C18H23 |
AB3C18D23 |
-0.09 |
2.47 |
-9.01 |
-0.1 |
0 |
|
|
350013 |
127276886 |
1 |
N2O2C15H20 |
A2B2C15D20 |
-59.09 |
4.56 |
-8.67 |
0.2 |
0 |
|
|
350014 |
127276887 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-62.45 |
7.8 |
-8.82 |
0.07 |
0 |
|
|
350015 |
127276888 |
1 |
ON5C22H25 |
AB5C22D25 |
48.07 |
3.99 |
-8.86 |
-0.51 |
0 |
|
|
350016 |
127276889 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-58.96 |
3.8 |
-8.72 |
0.15 |
0 |
|
|
350017 |
127276890 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-66.33 |
3.75 |
-8.52 |
-0.3 |
0 |
|
|
350018 |
127276891 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-78.83 |
6.7 |
-8.32 |
-0.3 |
0 |
|
|
350019 |
127276892 |
1 |
ON2C14H20 |
AB2C14D20 |
-30.71 |
3.43 |
-8.9 |
0.24 |
0 |
|
|
350020 |
127276893 |
1 |
ON2C15H22 |
AB2C15D22 |
-34.34 |
3.94 |
-8.78 |
0.07 |
0 |
|
|
350021 |
127276894 |
2 |
ON2C10H11 |
AB2C10D11 |
25.43 |
4.9 |
-9.14 |
-1.16 |
0 |
|
|
350022 |
127276895 |
1 |
O2N4C21H22 |
A2B4C21D22 |
46.56 |
5.98 |
-9.24 |
-1.12 |
0 |
|
|
350023 |
127276896 |
1 |
N3O3C21H23 |
A3B3C21D23 |
-68.12 |
1.31 |
-8.77 |
-0.34 |
0 |
|
|
350024 |
127276897 |
1 |
ON3C17H21 |
AB3C17D21 |
5.43 |
3.09 |
-8.62 |
0.22 |
0 |
|
|
350025 |
127276898 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-77.24 |
7.56 |
-8.59 |
-0.29 |
0 |
|
|
350026 |
127276899 |
1 |
ON2C14H18 |
AB2C14D18 |
1.32 |
3.43 |
-8.91 |
0.22 |
0 |
|
|
350027 |
127276900 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-39.5 |
6.52 |
-8.54 |
0.06 |
0 |
|
|
350028 |
127276901 |
1 |
SO2N5C11H15 |
AB2C5D11E15 |
-20.27 |
6.96 |
-9.01 |
-0.66 |
0 |
|
|
350029 |
127276902 |
2 |
N4C6H7 |
A4B6C7 |
154.51 |
9.01 |
-9.49 |
-1.35 |
0 |
|
|
350030 |
127276903 |
1 |
F3N7C14H14 |
A3B7C14D14 |
-33.63 |
9.07 |
-9.6 |
-1.35 |
0 |
|
|
350031 |
127276904 |
2 |
NO2C8H13 |
AB2C8D13 |
-199.44 |
1.68 |
-9.67 |
-0.12 |
0 |
|
|
350032 |
127276905 |
1 |
N2O5C15H16 |
A2B5C15D16 |
-171.26 |
1.26 |
-8.88 |
-0.36 |
0 |
|
|
350033 |
127276906 |
1 |
OCl2N5C17H19 |
AB2C5D17E19 |
43.52 |
1.59 |
-9.23 |
-1.12 |
0 |
|
|
350034 |
127276907 |
1 |
SN2O2C13H26 |
AB2C2D13E26 |
-108.19 |
6.25 |
-8.31 |
0.51 |
0 |
|
|
350035 |
127276908 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-97.89 |
1.76 |
-9.18 |
-0.11 |
0 |
|
|
350036 |
127276909 |
1 |
O2N4C21H30 |
A2B4C21D30 |
-44.39 |
5.85 |
-9.1 |
-0.06 |
0 |
|
|
350037 |
127276910 |
2 |
ON2C11H16 |
AB2C11D16 |
-46.36 |
8.92 |
-8.88 |
0.23 |
0 |
|
|
350038 |
127276911 |
1 |
N2O3C19H28 |
A2B3C19D28 |
-106.66 |
4.21 |
-8.73 |
0.35 |
0 |
|
|
350039 |
127276912 |
1 |
ON7C19H23 |
AB7C19D23 |
95.76 |
8.92 |
-9.34 |
-0.86 |
0 |
|
|
350040 |
127276913 |
1 |
O2N5C22H31 |
A2B5C22D31 |
-15.29 |
1.22 |
-9.16 |
-0.81 |
0 |
|
|
350041 |
127276914 |
1 |
O2N5C22H31 |
A2B5C22D31 |
-11.69 |
4.81 |
-9.07 |
-0.79 |
0 |
|
|
350042 |
127276915 |
1 |
O2N5C22H31 |
A2B5C22D31 |
-11.01 |
4.2 |
-9.14 |
-0.92 |
0 |
|
|
350043 |
127276916 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-9.88 |
4.1 |
-9.18 |
-1.06 |
0 |
|
|
350044 |
127276917 |
1 |
ON2C14H28 |
AB2C14D28 |
-74.93 |
1.48 |
-8.47 |
2.22 |
0 |
|
|
350045 |
127276918 |
1 |
SO2N4C20H32 |
AB2C4D20E32 |
-70.41 |
4.02 |
-8.65 |
-0.34 |
0 |
|
|
350046 |
127276919 |
1 |
O3N4C17H30 |
A3B4C17D30 |
-144.6 |
2.46 |
-8.74 |
-0.01 |
0 |
|
|
350047 |
127276920 |
1 |
O2N5C21H37 |
A2B5C21D37 |
-82.39 |
5.96 |
-8.7 |
0.46 |
0 |
|
|
350048 |
127276921 |
1 |
ClO2N4C20H31 |
AB2C4D20E31 |
-89.96 |
2.86 |
-8.98 |
-0.51 |
0 |
|
|
350049 |
127276922 |
1 |
N3O4C21H31 |
A3B4C21D31 |
-149.82 |
2.93 |
-8.37 |
-0.09 |
0 |
|
|
350050 |
127276923 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-55.48 |
3.04 |
-8.38 |
-0.32 |
0 |
|
|
350051 |
127276924 |
1 |
OF2N5C18H21 |
AB2C5D18E21 |
-44.95 |
10.66 |
-9.11 |
-0.7 |
0 |
|
|
350052 |
127276925 |
1 |
ON6C20H26 |
AB6C20D26 |
75.45 |
7.69 |
-8.96 |
-0.4 |
0 |
|
|
350053 |
127276926 |
1 |
SO3N4C18H26 |
AB3C4D18E26 |
-84.31 |
7.71 |
-8.94 |
-0.6 |
0 |
|
|
350054 |
127276927 |
1 |
N3O3C21H31 |
A3B3C21D31 |
-108.89 |
5.09 |
-8.7 |
0.1 |
0 |
|
|
350055 |
127276928 |
1 |
SO2N4C19H30 |
AB2C4D19E30 |
-72.86 |
2.67 |
-8.7 |
-0.24 |
0 |
|
|
350056 |
127276929 |
1 |
SO2N4C18H28 |
AB2C4D18E28 |
-65.8 |
3.67 |
-8.34 |
-0.16 |
0 |
|
|
350057 |
127276930 |
1 |
O2N5C20H35 |
A2B5C20D35 |
-75.86 |
5.27 |
-8.86 |
0.46 |
0 |
|
|
350058 |
127276931 |
1 |
O2N5C20H35 |
A2B5C20D35 |
-76.36 |
6.21 |
-8.55 |
0.53 |
0 |
|
|
350059 |
127276932 |
1 |
SO2N4C20H28 |
AB2C4D20E28 |
-44.7 |
4.4 |
-8.86 |
-0.6 |
0 |
|
|
350060 |
127276933 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-101.14 |
3.37 |
-8.78 |
-0.32 |
0 |
|
|
350061 |
127276934 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-54.98 |
4.18 |
-8.52 |
-0.12 |
0 |
|
|
350062 |
127276935 |
1 |
O3N4C21H26 |
A3B4C21D26 |
-49.68 |
8.63 |
-8.92 |
-0.91 |
0 |
|
|
350063 |
127276936 |
1 |
N3O4C19H27 |
A3B4C19D27 |
-132.44 |
3.74 |
-8.55 |
-0.3 |
0 |
|
|
350064 |
127276937 |
1 |
SN3O3C16H29 |
AB3C3D16E29 |
-145.82 |
4.97 |
-9.01 |
0.65 |
0 |
|
|
350065 |
127276938 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-43.38 |
2.74 |
-8.94 |
-0.19 |
0 |
|
|
350066 |
127276939 |
1 |
SO2N3C19H27 |
AB2C3D19E27 |
-78.78 |
6.0 |
-8.74 |
-0.15 |
0 |
|
|
350067 |
127276940 |
1 |
SO2N3C14H19 |
AB2C3D14E19 |
-52.39 |
9.05 |
-9.32 |
-0.56 |
0 |
|
|
350068 |
127276941 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-122.87 |
1.45 |
-8.93 |
0.89 |
0 |
|
|
350069 |
127276942 |
1 |
O2N5C17H25 |
A2B5C17D25 |
-31.87 |
9.68 |
-8.93 |
-0.42 |
0 |
|
|
350070 |
127276943 |
1 |
SN3O3C20H31 |
AB3C3D20E31 |
-127.67 |
2.76 |
-8.86 |
-0.56 |
0 |
|
|
350071 |
127276944 |
1 |
SO3N4C16H26 |
AB3C4D16E26 |
-108.92 |
5.02 |
-9.0 |
0.03 |
0 |
|
|
350072 |
127276945 |
1 |
SN2O3C18H32 |
AB2C3D18E32 |
-160.64 |
3.77 |
-8.75 |
0.64 |
0 |
|
|
350073 |
127276946 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-77.7 |
3.45 |
-8.7 |
-0.49 |
0 |
|
|
350074 |
127276947 |
1 |
O2N3C19H31 |
A2B3C19D31 |
-135.8 |
3.9 |
-8.86 |
0.48 |
0 |
|
|
350075 |
127276948 |
1 |
NOC11H21 |
ABC11D21 |
-69.22 |
1.65 |
-8.65 |
2.28 |
0 |
|
|
350076 |
127276949 |
1 |
F3N6C19H25 |
A3B6C19D25 |
-69.74 |
3.94 |
-8.6 |
-1.45 |
0 |
|
|
350077 |
127276950 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-30.15 |
1.74 |
-8.61 |
-0.88 |
0 |
|
|
350078 |
127276951 |
1 |
SO2N4C18H26 |
AB2C4D18E26 |
-53.12 |
9.92 |
-8.93 |
-0.55 |
0 |
|
|
350079 |
127276952 |
2 |
ON2C10H18 |
AB2C10D18 |
-124.77 |
2.56 |
-8.58 |
0.84 |
0 |
|
|
350080 |
127276953 |
1 |
N6C15H26 |
A6B15C26 |
76.94 |
6.4 |
-8.54 |
-0.38 |
0 |
|
|
350081 |
127276954 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-48.1 |
6.47 |
-8.77 |
0.26 |
0 |
|
|
350082 |
127276955 |
4 |
NOC5H7 |
ABC5D7 |
-147.06 |
4.07 |
-8.44 |
-0.29 |
0 |
|
|
350083 |
127276956 |
1 |
O2N4C21H32 |
A2B4C21D32 |
-100.75 |
3.67 |
-8.62 |
-0.04 |
0 |
|
|
350084 |
127276957 |
1 |
O2N4C21H32 |
A2B4C21D32 |
-101.98 |
2.64 |
-8.48 |
0.0 |
0 |