List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
75052 |
48422923 |
1 |
N2O2C19H30 |
A2B2C19D30 |
-64.04 |
4.38 |
-9.12 |
0.35 |
0 |
|
|
75053 |
48422924 |
1 |
ClN2O2C18H25 |
AB2C2D18E25 |
-61.15 |
2.04 |
-8.9 |
-0.11 |
0 |
|
|
75054 |
48422926 |
2 |
NO2C9H10 |
AB2C9D10 |
-99.73 |
6.33 |
-8.73 |
-0.72 |
0 |
|
|
75055 |
48422927 |
1 |
N3O4C21H25 |
A3B4C21D25 |
-132.91 |
2.39 |
-9.4 |
-0.27 |
0 |
|
|
75056 |
48422928 |
1 |
N2O3C17H24 |
A2B3C17D24 |
-97.86 |
4.41 |
-9.37 |
-0.25 |
0 |
|
|
75057 |
48422929 |
1 |
ClN2O2C17H25 |
AB2C2D17E25 |
-65.08 |
3.12 |
-9.02 |
-0.24 |
0 |
|
|
75058 |
48422931 |
1 |
N4O5C21H30 |
A4B5C21D30 |
-193.5 |
1.55 |
-9.13 |
0.11 |
0 |
|
|
75059 |
48422932 |
1 |
N3O4C17H29 |
A3B4C17D29 |
-149.12 |
3.64 |
-9.06 |
0.18 |
0 |
|
|
75060 |
48422933 |
2 |
NOC8H11 |
ABC8D11 |
-19.67 |
6.39 |
-9.59 |
-0.23 |
0 |
|
|
75061 |
48422934 |
1 |
N3O3C24H31 |
A3B3C24D31 |
-105.75 |
3.19 |
-8.6 |
0.09 |
0 |
|
|
75062 |
48422935 |
2 |
NOC10H15 |
ABC10D15 |
-66.7 |
2.44 |
-8.5 |
0.24 |
0 |
|
|
75063 |
48422936 |
1 |
N3O3C23H29 |
A3B3C23D29 |
-86.37 |
4.64 |
-8.78 |
0.15 |
0 |
|
|
75064 |
48422937 |
1 |
N2O2C19H28 |
A2B2C19D28 |
-50.25 |
4.97 |
-8.57 |
0.57 |
0 |
|
|
75065 |
48422938 |
1 |
SN2O3C17H26 |
AB2C3D17E26 |
-84.23 |
4.28 |
-9.1 |
-0.43 |
0 |
|
|
75066 |
48422939 |
1 |
SN2O5C16H22 |
AB2C5D16E22 |
-212.92 |
3.88 |
-9.73 |
0.01 |
0 |
|
|
75067 |
48422940 |
1 |
NSO4C12H21 |
ABC4D12E21 |
-173.59 |
7.37 |
-10.09 |
0.65 |
0 |
|
|
75068 |
48422942 |
1 |
ClN3O3C21H26 |
AB3C3D21E26 |
-94.8 |
4.95 |
-9.08 |
-0.47 |
0 |
|
|
75069 |
48422943 |
1 |
SN3O4C21H27 |
AB3C4D21E27 |
-123.19 |
2.59 |
-9.08 |
-0.29 |
0 |
|
|
75070 |
48422944 |
1 |
ClFN2O2C18H24 |
ABC2D2E18F24 |
-106.36 |
2.65 |
-8.77 |
-0.42 |
0 |
|
|
75071 |
48422950 |
1 |
FN3O3C23H28 |
AB3C3D23E28 |
-138.34 |
3.64 |
-8.72 |
0.09 |
0 |
|
|
75072 |
48422951 |
1 |
FN2O2C19H27 |
AB2C2D19E27 |
-100.32 |
3.89 |
-8.82 |
0.04 |
0 |
|
|
75073 |
48422952 |
1 |
N3O3C24H31 |
A3B3C24D31 |
-94.45 |
3.53 |
-9.12 |
0.3 |
0 |
|
|
75074 |
48422954 |
1 |
N2O3C20H30 |
A2B3C20D30 |
-95.35 |
1.75 |
-8.64 |
0.3 |
0 |
|
|
75075 |
48422955 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-24.4 |
4.81 |
-8.61 |
-0.81 |
0 |
|
|
75076 |
48422956 |
1 |
N3O4C20H31 |
A3B4C20D31 |
-173.39 |
2.88 |
-8.93 |
0.22 |
0 |
|
|
75077 |
48422958 |
1 |
N3O4C23H27 |
A3B4C23D27 |
-137.83 |
4.57 |
-9.62 |
-0.24 |
0 |
|
|
75078 |
48422959 |
1 |
N2O3C19H26 |
A2B3C19D26 |
-98.21 |
5.46 |
-9.62 |
-0.27 |
0 |
|
|
75079 |
48422960 |
1 |
SN2O2C15H24 |
AB2C2D15E24 |
-48.23 |
1.38 |
-8.85 |
-0.13 |
0 |
|
|
75080 |
48422961 |
1 |
NO2C17H25 |
AB2C17D25 |
-62.75 |
5.75 |
-9.39 |
-0.04 |
0 |
|
|
75081 |
48422962 |
1 |
N3O3C20H31 |
A3B3C20D31 |
-138.24 |
3.64 |
-8.82 |
0.14 |
0 |
|
|
75082 |
48422963 |
2 |
NOC8H15 |
ABC8D15 |
-106.83 |
3.37 |
-8.66 |
1.12 |
0 |
|
|
75083 |
48422964 |
1 |
SN3O3C19H25 |
AB3C3D19E25 |
-80.59 |
1.68 |
-8.93 |
-0.32 |
0 |
|
|
75084 |
48422967 |
1 |
N3O3C19H19 |
A3B3C19D19 |
-60.42 |
4.07 |
-9.61 |
-0.68 |
0 |
|
|
75085 |
48422968 |
1 |
N2O3C20H30 |
A2B3C20D30 |
-102.4 |
3.74 |
-8.65 |
0.08 |
0 |
|
|
75086 |
48422969 |
1 |
SN2O2C19H30 |
AB2C2D19E30 |
-63.91 |
3.5 |
-8.66 |
-0.05 |
0 |
|
|
75087 |
48422971 |
2 |
NOC8H15 |
ABC8D15 |
-97.59 |
2.31 |
-8.71 |
0.93 |
0 |
|
|
75088 |
48422974 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-97.25 |
7.13 |
-8.93 |
-0.12 |
0 |
|
|
75089 |
48422975 |
1 |
N2O2C19H30 |
A2B2C19D30 |
-65.16 |
3.32 |
-8.72 |
0.24 |
0 |
|
|
75090 |
48422976 |
1 |
N2O2C19H28 |
A2B2C19D28 |
-60.95 |
3.82 |
-9.02 |
0.18 |
0 |
|
|
75091 |
48422977 |
1 |
N2O3C21H32 |
A2B3C21D32 |
-107.7 |
2.36 |
-8.64 |
0.2 |
0 |
|
|
75092 |
48422978 |
2 |
NO2C10H15 |
AB2C10D15 |
-135.71 |
4.76 |
-8.76 |
0.04 |
0 |
|
|
75093 |
48422979 |
1 |
N3O4C22H29 |
A3B4C22D29 |
-132.91 |
3.85 |
-8.91 |
0.13 |
0 |
|
|
75094 |
48422981 |
1 |
N3O4C19H25 |
A3B4C19D25 |
-123.63 |
3.25 |
-8.92 |
0.14 |
0 |
|
|
75095 |
48422988 |
1 |
N3O4C19H29 |
A3B4C19D29 |
-170.65 |
3.51 |
-8.9 |
0.04 |
0 |
|
|
75096 |
48422989 |
1 |
N2O3C15H28 |
A2B3C15D28 |
-137.05 |
2.23 |
-8.89 |
1.13 |
0 |
|
|
75097 |
48422990 |
3 |
NOC7H11 |
ABC7D11 |
-134.39 |
2.51 |
-8.69 |
0.26 |
0 |
|
|
75098 |
48422991 |
1 |
N2O2C17H32 |
A2B2C17D32 |
-97.52 |
2.34 |
-8.69 |
1.13 |
0 |
|
|
75099 |
48422992 |
1 |
SN3O3C20H21 |
AB3C3D20E21 |
-72.12 |
2.65 |
-9.05 |
-0.64 |
0 |
|
|
75100 |
48422993 |
1 |
SN2O2C16H20 |
AB2C2D16E20 |
-36.85 |
2.88 |
-9.12 |
-0.67 |
0 |
|
|
75101 |
48422994 |
1 |
NO3C18H25 |
AB3C18D25 |
-82.89 |
4.28 |
-8.94 |
0.06 |
0 |
|
|
75102 |
48422995 |
1 |
O3N5C20H21 |
A3B5C20D21 |
-32.44 |
4.92 |
-9.18 |
-0.77 |
0 |
|
|
75103 |
48422996 |
1 |
NO3C17H25 |
AB3C17D25 |
-103.12 |
2.87 |
-8.83 |
0.22 |
0 |
|
|
75104 |
48422998 |
1 |
N2O3C19H28 |
A2B3C19D28 |
-94.54 |
2.72 |
-8.79 |
0.1 |
0 |
|
|
75105 |
48422999 |
1 |
N2O3C20H32 |
A2B3C20D32 |
-105.7 |
3.14 |
-8.7 |
0.12 |
0 |
|
|
75106 |
48423000 |
1 |
NO4C18H27 |
AB4C18D27 |
-141.04 |
1.52 |
-8.35 |
0.18 |
0 |
|
|
75107 |
48423001 |
1 |
N2O3C13H22 |
A2B3C13D22 |
-120.9 |
2.6 |
-9.53 |
0.41 |
0 |
|
|
75108 |
48423003 |
2 |
ON2C8H10 |
AB2C8D10 |
2.83 |
4.26 |
-9.18 |
-0.8 |
0 |
|
|
75109 |
48423005 |
3 |
NOC5H9 |
ABC5D9 |
-134.69 |
5.17 |
-9.33 |
0.94 |
0 |
|
|
75110 |
48423006 |
1 |
N3O3C17H25 |
A3B3C17D25 |
-88.87 |
3.94 |
-8.65 |
-0.06 |
0 |
|
|
75111 |
48423007 |
2 |
NOC7H14 |
ABC7D14 |
-99.52 |
2.32 |
-8.7 |
1.03 |
0 |
|
|
75112 |
48423008 |
1 |
N2O5C22H28 |
A2B5C22D28 |
-176.45 |
5.81 |
-8.43 |
0.04 |
0 |
|
|
75113 |
48423009 |
1 |
N4O4C21H26 |
A4B4C21D26 |
-123.05 |
2.91 |
-8.71 |
-0.08 |
0 |
|
|
75114 |
48423011 |
2 |
NOC7H14 |
ABC7D14 |
-97.57 |
3.54 |
-8.29 |
0.94 |
0 |
|
|
75115 |
48423012 |
1 |
N3O3C18H29 |
A3B3C18D29 |
-131.71 |
2.63 |
-8.7 |
0.16 |
0 |
|
|
75116 |
48423014 |
1 |
NF2O3C17H23 |
AB2C3D17E23 |
-210.83 |
2.79 |
-9.53 |
-0.2 |
0 |
|
|
75117 |
48423017 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-84.2 |
6.13 |
-9.48 |
-0.17 |
0 |
|
|
75118 |
48423018 |
1 |
O2N4C15H24 |
A2B4C15D24 |
-50.31 |
4.58 |
-9.61 |
0.3 |
0 |
|
|
75119 |
48423022 |
1 |
N2O3C17H32 |
A2B3C17D32 |
-144.48 |
4.08 |
-8.76 |
1.17 |
0 |
|
|
75120 |
48423023 |
1 |
N3O3C18H29 |
A3B3C18D29 |
-128.0 |
4.54 |
-8.96 |
0.31 |
0 |
|
|
75121 |
48423025 |
1 |
N2O5C23H30 |
A2B5C23D30 |
-183.33 |
1.27 |
-8.3 |
0.16 |
0 |
|
|
75122 |
48423029 |
2 |
NOC9H11 |
ABC9D11 |
-36.38 |
3.33 |
-9.2 |
-0.74 |
0 |
|
|
75123 |
48423032 |
1 |
SN2O3C16H20 |
AB2C3D16E20 |
-60.56 |
1.29 |
-8.74 |
-0.73 |
0 |
|
|
75124 |
48423036 |
1 |
O3N4C21H22 |
A3B4C21D22 |
-33.29 |
4.67 |
-8.96 |
-0.44 |
0 |
|
|
75125 |
48423038 |
1 |
N3O3C22H23 |
A3B3C22D23 |
-69.8 |
2.73 |
-9.24 |
-0.78 |
0 |
|
|
75126 |
48423039 |
1 |
N2O4C21H26 |
A2B4C21D26 |
-145.61 |
3.29 |
-9.44 |
-0.07 |
0 |
|
|
75127 |
48423042 |
1 |
N3O5C21H25 |
A3B5C21D25 |
-176.06 |
3.78 |
-9.05 |
-0.19 |
0 |
|
|
75128 |
48423046 |
1 |
NO3C17H25 |
AB3C17D25 |
-106.15 |
3.52 |
-9.26 |
0.18 |
0 |
|
|
75129 |
48423048 |
1 |
O2N3C17H25 |
A2B3C17D25 |
-53.37 |
4.2 |
-8.38 |
0.17 |
0 |
|
|
75130 |
48423055 |
1 |
FN2O4C21H25 |
AB2C4D21E25 |
-187.29 |
3.55 |
-8.94 |
-0.15 |
0 |
|
|
75131 |
48423056 |
2 |
NO2C10H12 |
AB2C10D12 |
-135.11 |
5.42 |
-9.49 |
-0.09 |
0 |
|
|
75132 |
48423068 |
1 |
N2O3C19H26 |
A2B3C19D26 |
-108.29 |
5.97 |
-9.42 |
-0.07 |
0 |
|
|
75133 |
48423070 |
1 |
O3N4C16H20 |
A3B4C16D20 |
-71.2 |
3.31 |
-9.66 |
-0.1 |
0 |
|
|
75134 |
48423071 |
2 |
NOC10H16 |
ABC10D16 |
-74.29 |
2.2 |
-8.49 |
0.39 |
0 |
|
|
75135 |
48423072 |
1 |
O2F3N3C21H30 |
A2B3C3D21E30 |
-220.56 |
7.52 |
-8.38 |
-0.24 |
0 |
|
|
75136 |
48423073 |
1 |
O2N3C21H33 |
A2B3C21D33 |
-49.91 |
3.81 |
-8.56 |
0.26 |
0 |
|
|
75137 |
48423074 |
1 |
O3N5C20H21 |
A3B5C20D21 |
-34.03 |
3.93 |
-9.69 |
-0.7 |
0 |
|
|
75138 |
48423076 |
2 |
ON2C8H13 |
AB2C8D13 |
-46.98 |
3.4 |
-9.63 |
0.4 |
0 |
|
|
75139 |
48423078 |
1 |
O3N5C20H21 |
A3B5C20D21 |
-31.0 |
1.98 |
-9.29 |
-0.77 |
0 |
|
|
75140 |
48423080 |
3 |
NOC6H7 |
ABC6D7 |
-83.68 |
2.98 |
-9.52 |
-0.41 |
0 |
|
|
75141 |
48423081 |
1 |
ClN2O2C19H27 |
AB2C2D19E27 |
-76.4 |
3.18 |
-9.09 |
-0.05 |
0 |
|
|
75142 |
48423082 |
1 |
N3O4C22H35 |
A3B4C22D35 |
-177.07 |
4.73 |
-8.51 |
0.07 |
0 |
|
|
75143 |
48423083 |
1 |
N2O3C18H34 |
A2B3C18D34 |
-138.01 |
2.82 |
-8.8 |
0.72 |
0 |
|
|
75144 |
48423084 |
1 |
N2O3C16H28 |
A2B3C16D28 |
-149.35 |
5.03 |
-9.38 |
1.0 |
0 |
|
|
75145 |
48423085 |
1 |
O3N5C15H19 |
A3B5C15D19 |
-65.1 |
5.81 |
-9.66 |
-0.08 |
0 |
|
|
75146 |
48423086 |
1 |
O3N4C22H24 |
A3B4C22D24 |
-55.46 |
4.1 |
-9.36 |
-0.32 |
0 |
|
|
75147 |
48423087 |
1 |
O2N3C18H23 |
A2B3C18D23 |
-19.94 |
3.15 |
-9.37 |
-0.45 |
0 |
|
|
75148 |
48423088 |
1 |
O3N4C23H26 |
A3B4C23D26 |
-66.15 |
6.53 |
-8.99 |
-0.21 |
0 |
|
|
75149 |
48423089 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-58.07 |
1.6 |
-9.24 |
0.82 |
0 |
|
|
75150 |
48423090 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-29.92 |
5.54 |
-9.61 |
0.34 |
0 |
|
|
75151 |
48423091 |
1 |
ClO3N4C19H19 |
AB3C4D19E19 |
-64.77 |
5.18 |
-9.32 |
-1.01 |
0 |