List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
213070 |
81062752 |
1 |
O2N3C12H27 |
A2B3C12D27 |
-109.15 |
4.38 |
-8.79 |
1.09 |
0 |
|
|
213071 |
81062753 |
1 |
N2O3C15H30 |
A2B3C15D30 |
-163.11 |
4.88 |
-8.65 |
1.21 |
0 |
|
|
213072 |
81062754 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-75.98 |
5.35 |
-8.61 |
0.32 |
0 |
|
|
213073 |
81062762 |
1 |
N2O3C15H30 |
A2B3C15D30 |
-140.45 |
1.31 |
-8.77 |
0.74 |
0 |
|
|
213074 |
81062763 |
1 |
N2O3C14H30 |
A2B3C14D30 |
-159.72 |
2.31 |
-8.66 |
0.76 |
0 |
|
|
213075 |
81062765 |
1 |
N2O3C14H28 |
A2B3C14D28 |
-162.02 |
2.84 |
-8.67 |
0.59 |
0 |
|
|
213076 |
81062766 |
1 |
SN3O3C11H19 |
AB3C3D11E19 |
-106.47 |
5.84 |
-9.1 |
-0.35 |
0 |
|
|
213077 |
81062770 |
1 |
N2O3C15H30 |
A2B3C15D30 |
-159.64 |
3.48 |
-8.83 |
0.86 |
0 |
|
|
213078 |
81062785 |
1 |
ClON2C12H19 |
ABC2D12E19 |
-39.78 |
1.85 |
-8.5 |
-0.06 |
0 |
|
|
213079 |
81062787 |
1 |
BrNOC11H22 |
ABCD11E22 |
-55.77 |
4.6 |
-8.8 |
0.3 |
0 |
|
|
213080 |
81062791 |
1 |
ClNO2C10H22 |
ABC2D10E22 |
-116.32 |
2.85 |
-9.04 |
0.67 |
0 |
|
|
213081 |
81062793 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-75.54 |
5.02 |
-9.21 |
-0.53 |
0 |
|
|
213082 |
81062802 |
1 |
NSO2C15H23 |
ABC2D15E23 |
-31.2 |
2.47 |
-8.71 |
-0.25 |
0 |
|
|
213083 |
81062808 |
1 |
NO3C15H25 |
AB3C15D25 |
-122.31 |
2.3 |
-8.7 |
0.27 |
0 |
|
|
213084 |
81062809 |
1 |
ClNSO3C13H20 |
ABCD3E13F20 |
-122.41 |
4.06 |
-9.48 |
-0.78 |
0 |
|
|
213085 |
81062810 |
1 |
NO4C15H25 |
AB4C15D25 |
-155.53 |
3.79 |
-8.6 |
0.32 |
0 |
|
|
213086 |
81062812 |
1 |
NSO3C14H19 |
ABC3D14E19 |
-74.24 |
5.75 |
-9.21 |
-0.84 |
0 |
|
|
213087 |
81062816 |
1 |
NO4C12H17 |
AB4C12D17 |
-174.97 |
3.2 |
-9.21 |
0.16 |
0 |
|
|
213088 |
81062819 |
1 |
BrNSO3C10H12 |
ABCD3E10F12 |
-104.25 |
2.14 |
-9.69 |
-0.93 |
0 |
|
|
213089 |
81062820 |
1 |
NF3O4C12H12 |
AB3C4D12E12 |
-293.57 |
3.47 |
-10.06 |
-1.31 |
0 |
|
|
213090 |
81062821 |
1 |
NO3C13H17 |
AB3C13D17 |
-130.1 |
3.26 |
-9.61 |
-0.2 |
0 |
|
|
213091 |
81062827 |
1 |
BrNO4C15H18 |
ABC4D15E18 |
-145.46 |
6.46 |
-9.14 |
-0.86 |
0 |
|
|
213092 |
81062828 |
1 |
N2O6C13H16 |
A2B6C13D16 |
-162.86 |
7.61 |
-10.12 |
-1.59 |
0 |
|
|
213093 |
81062831 |
1 |
N3O3C11H17 |
A3B3C11D17 |
-116.74 |
1.43 |
-9.51 |
0.35 |
0 |
|
|
213094 |
81062832 |
1 |
S2N3O3C13H13 |
A2B3C3D13E13 |
-52.14 |
5.99 |
-8.89 |
-1.4 |
0 |
|
|
213095 |
81062835 |
1 |
NO5C10H17 |
AB5C10D17 |
-228.15 |
3.0 |
-9.8 |
0.49 |
0 |
|
|
213096 |
81062836 |
1 |
SN3O3C8H11 |
AB3C3D8E11 |
-80.7 |
3.31 |
-10.37 |
-1.75 |
0 |
|
|
213097 |
81062839 |
1 |
NO3C17H25 |
AB3C17D25 |
-146.33 |
3.12 |
-9.54 |
0.05 |
0 |
|
|
213098 |
81062849 |
1 |
N2O4C11H16 |
A2B4C11D16 |
-142.18 |
4.01 |
-10.04 |
-0.39 |
0 |
|
|
213099 |
81062881 |
1 |
NO3C13H25 |
AB3C13D25 |
-182.96 |
2.96 |
-9.83 |
0.46 |
0 |
|
|
213100 |
81062883 |
1 |
SN2O3C15H26 |
AB2C3D15E26 |
-130.44 |
6.96 |
-8.99 |
-0.27 |
0 |
|
|
213101 |
81062884 |
1 |
N2O3C16H30 |
A2B3C16D30 |
-139.99 |
4.2 |
-8.59 |
1.19 |
0 |
|
|
213102 |
81062885 |
1 |
O2N3C16H35 |
A2B3C16D35 |
-132.36 |
7.37 |
-8.59 |
1.54 |
0 |
|
|
213103 |
81062890 |
1 |
BrSN3O3C13H22 |
ABC3D3E13F22 |
-116.78 |
3.89 |
-9.1 |
-0.77 |
0 |
|
|
213104 |
81062894 |
1 |
N2O3C16H34 |
A2B3C16D34 |
-169.94 |
1.09 |
-8.49 |
1.09 |
0 |
|
|
213105 |
81062895 |
1 |
N2O3C16H34 |
A2B3C16D34 |
-169.08 |
1.87 |
-8.46 |
1.14 |
0 |
|
|
213106 |
81062901 |
1 |
N2O3C16H32 |
A2B3C16D32 |
-167.95 |
1.47 |
-8.75 |
0.76 |
0 |
|
|
213107 |
81062902 |
1 |
FN3O4C13H18 |
AB3C4D13E18 |
-117.36 |
7.36 |
-9.32 |
-1.43 |
0 |
|
|
213108 |
81062908 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-42.68 |
3.91 |
-8.65 |
-0.73 |
0 |
|
|
213109 |
81062909 |
1 |
N3O4C14H21 |
A3B4C14D21 |
-83.78 |
8.25 |
-9.03 |
-1.0 |
0 |
|
|
213110 |
81062910 |
1 |
N2O2F3C14H19 |
A2B2C3D14E19 |
-236.73 |
2.95 |
-8.82 |
-0.38 |
0 |
|
|
213111 |
81062915 |
1 |
ON3C17H25 |
AB3C17D25 |
-9.84 |
2.31 |
-8.47 |
-0.38 |
0 |
|
|
213112 |
81062917 |
1 |
OSN4C15H24 |
ABC4D15E24 |
-7.17 |
3.96 |
-8.6 |
-0.61 |
0 |
|
|
213113 |
81062919 |
1 |
N3O3C15H25 |
A3B3C15D25 |
-46.15 |
9.03 |
-8.89 |
-0.82 |
0 |
|
|
213114 |
81062920 |
1 |
N3O3C15H25 |
A3B3C15D25 |
-53.65 |
6.25 |
-8.83 |
-0.83 |
0 |
|
|
213115 |
81062921 |
1 |
N3O4C14H21 |
A3B4C14D21 |
-86.67 |
5.76 |
-9.11 |
-1.24 |
0 |
|
|
213116 |
81062923 |
1 |
ON6C14H24 |
AB6C14D24 |
13.19 |
1.54 |
-8.71 |
-0.26 |
0 |
|
|
213117 |
81062929 |
1 |
N2O2F3C14H19 |
A2B2C3D14E19 |
-242.54 |
4.39 |
-9.22 |
-0.61 |
0 |
|
|
213118 |
81062930 |
1 |
O3N4C11H18 |
A3B4C11D18 |
-10.1 |
3.43 |
-9.07 |
-0.78 |
0 |
|
|
213119 |
81062931 |
1 |
ON5C10H19 |
AB5C10D19 |
-6.34 |
4.37 |
-8.88 |
0.09 |
0 |
|
|
213120 |
81062933 |
1 |
N2O2C17H28 |
A2B2C17D28 |
-46.05 |
4.13 |
-8.97 |
0.54 |
0 |
|
|
213121 |
81062937 |
1 |
N2O3C10H22 |
A2B3C10D22 |
-147.15 |
4.08 |
-9.67 |
0.64 |
0 |
|
|
213122 |
81062942 |
1 |
N2O2C15H34 |
A2B2C15D34 |
-138.24 |
2.15 |
-8.72 |
2.09 |
0 |
|
|
213123 |
81062943 |
2 |
NOC6H14 |
ABC6D14 |
-116.92 |
2.75 |
-8.78 |
2.01 |
0 |
|
|
213124 |
81062944 |
2 |
NOC6H13 |
ABC6D13 |
-90.96 |
4.02 |
-8.98 |
1.89 |
0 |
|
|
213125 |
81062945 |
1 |
N2O2C15H32 |
A2B2C15D32 |
-129.83 |
2.88 |
-8.85 |
1.93 |
0 |
|
|
213126 |
81062946 |
1 |
N2O2C13H28 |
A2B2C13D28 |
-120.26 |
1.25 |
-8.59 |
2.14 |
0 |
|
|
213127 |
81062947 |
1 |
ClFNSO3C13H19 |
ABCDE3F13G19 |
-174.31 |
3.25 |
-9.76 |
-0.94 |
0 |
|
|
213128 |
81062948 |
1 |
ClNSO3C13H20 |
ABCD3E13F20 |
-128.78 |
4.17 |
-9.56 |
-0.82 |
0 |
|
|
213129 |
81062949 |
1 |
ClNS2O3C10H16 |
ABC2D3E10F16 |
-109.55 |
5.92 |
-9.57 |
-1.08 |
0 |
|
|
213130 |
81062950 |
1 |
ClNSO3C13H20 |
ABCD3E13F20 |
-127.48 |
4.83 |
-9.6 |
-0.66 |
0 |
|
|
213131 |
81062964 |
1 |
N2O4C15H24 |
A2B4C15D24 |
-186.03 |
2.36 |
-9.44 |
0.48 |
0 |
|
|
213132 |
81062966 |
1 |
N4O5C10H14 |
A4B5C10D14 |
-98.56 |
8.16 |
-10.6 |
-1.23 |
0 |
|
|
213133 |
81062970 |
1 |
O3N4C10H16 |
A3B4C10D16 |
-97.1 |
6.09 |
-10.32 |
-0.17 |
0 |
|
|
213134 |
81062978 |
1 |
NO3C16H17 |
AB3C16D17 |
-102.95 |
2.61 |
-9.14 |
-0.82 |
0 |
|
|
213135 |
81062985 |
1 |
SN2O5C11H20 |
AB2C5D11E20 |
-234.16 |
6.0 |
-9.77 |
0.04 |
0 |
|
|
213136 |
81062986 |
1 |
NO4C14H19 |
AB4C14D19 |
-163.45 |
6.16 |
-9.94 |
-0.24 |
0 |
|
|
213137 |
81062987 |
2 |
NO2C7H12 |
AB2C7D12 |
-213.88 |
6.11 |
-9.91 |
0.55 |
0 |
|
|
213138 |
81062988 |
1 |
FNO3C13H16 |
ABC3D13E16 |
-176.46 |
4.61 |
-9.75 |
-0.33 |
0 |
|
|
213139 |
81062989 |
1 |
NO4C13H17 |
AB4C13D17 |
-165.69 |
6.15 |
-9.92 |
-0.24 |
0 |
|
|
213140 |
81062990 |
1 |
NO4C14H17 |
AB4C14D17 |
-159.29 |
3.72 |
-9.14 |
-0.06 |
0 |
|
|
213141 |
81062991 |
1 |
N3O3C14H23 |
A3B3C14D23 |
-133.48 |
1.14 |
-8.96 |
0.46 |
0 |
|
|
213142 |
81062992 |
1 |
NO3C14H19 |
AB3C14D19 |
-139.17 |
4.3 |
-9.5 |
0.08 |
0 |
|
|
213143 |
81062993 |
1 |
ClN2O3C13H19 |
AB2C3D13E19 |
-144.29 |
4.46 |
-9.06 |
-0.06 |
0 |
|
|
213144 |
81063003 |
1 |
N4O5C12H18 |
A4B5C12D18 |
-130.26 |
7.88 |
-10.49 |
-1.12 |
0 |