List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
367892 |
127326045 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-37.68 |
2.07 |
-8.79 |
-0.07 |
0 |
|
|
367893 |
127326046 |
1 |
O2N5C20H25 |
A2B5C20D25 |
-14.28 |
3.43 |
-8.66 |
-0.1 |
0 |
|
|
367894 |
127326047 |
1 |
FON5C21H22 |
ABC5D21E22 |
3.45 |
10.51 |
-8.72 |
-0.49 |
0 |
|
|
367895 |
127326068 |
1 |
FON5C21H26 |
ABC5D21E26 |
-18.92 |
3.01 |
-8.55 |
-0.21 |
0 |
|
|
367896 |
127326069 |
1 |
ON5C21H27 |
AB5C21D27 |
29.95 |
4.73 |
-8.48 |
-0.1 |
0 |
|
|
367897 |
127326070 |
1 |
FON5C21H26 |
ABC5D21E26 |
-30.62 |
6.9 |
-8.58 |
-0.29 |
0 |
|
|
367898 |
127326071 |
1 |
ON5C21H27 |
AB5C21D27 |
17.76 |
5.66 |
-8.53 |
-0.25 |
0 |
|
|
367899 |
127326072 |
1 |
ON5C20H25 |
AB5C20D25 |
29.51 |
6.29 |
-8.83 |
-0.24 |
0 |
|
|
367900 |
127326073 |
1 |
FO2N5C20H26 |
AB2C5D20E26 |
-47.71 |
4.82 |
-8.94 |
-0.36 |
0 |
|
|
367901 |
127326074 |
1 |
O2N5C20H27 |
A2B5C20D27 |
2.09 |
3.15 |
-8.56 |
-0.35 |
0 |
|
|
367902 |
127326075 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-5.79 |
4.89 |
-8.61 |
-0.25 |
0 |
|
|
367903 |
127326076 |
1 |
ON5C17H21 |
AB5C17D21 |
27.04 |
9.04 |
-9.05 |
0.05 |
0 |
|
|
367904 |
127326077 |
1 |
FON5C19H24 |
ABC5D19E24 |
-33.75 |
8.54 |
-9.19 |
-0.23 |
0 |
|
|
367905 |
127326078 |
1 |
ON5C19H25 |
AB5C19D25 |
13.23 |
5.91 |
-9.07 |
-0.08 |
0 |
|
|
367906 |
127326079 |
1 |
ON5C19H25 |
AB5C19D25 |
20.62 |
5.76 |
-8.92 |
0.2 |
0 |
|
|
367907 |
127326080 |
1 |
N6C21H26 |
A6B21C26 |
84.52 |
2.6 |
-8.56 |
-0.18 |
0 |
|
|
367908 |
127326081 |
1 |
ON5C21H29 |
AB5C21D29 |
10.98 |
7.44 |
-8.73 |
0.1 |
0 |
|
|
367909 |
127326082 |
1 |
FO2N5C18H22 |
AB2C5D18E22 |
-52.23 |
10.08 |
-9.27 |
-0.32 |
0 |
|
|
367910 |
127326083 |
1 |
O2N5C18H23 |
A2B5C18D23 |
-4.35 |
8.94 |
-9.06 |
-0.06 |
0 |
|
|
367911 |
127326084 |
1 |
FO2N5C20H26 |
AB2C5D20E26 |
-72.83 |
2.75 |
-9.06 |
-0.12 |
0 |
|
|
367912 |
127326085 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-24.39 |
1.43 |
-8.85 |
0.19 |
0 |
|
|
367913 |
127326086 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-12.54 |
7.56 |
-8.96 |
0.03 |
0 |
|
|
367914 |
127326087 |
2 |
ON2C10H13 |
AB2C10D13 |
-19.68 |
2.4 |
-8.92 |
0.13 |
0 |
|
|
367915 |
127326088 |
1 |
FO2N4C21H27 |
AB2C4D21E27 |
-82.05 |
4.7 |
-8.95 |
-0.05 |
0 |
|
|
367916 |
127326089 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-33.28 |
2.96 |
-8.73 |
0.25 |
0 |
|
|
367917 |
127326090 |
1 |
ON5C20H27 |
AB5C20D27 |
15.02 |
8.75 |
-8.94 |
-0.13 |
0 |
|
|
367918 |
127326091 |
1 |
ON5C18H23 |
AB5C18D23 |
18.8 |
7.08 |
-8.96 |
0.05 |
0 |
|
|
367919 |
127326092 |
1 |
ON5C19H23 |
AB5C19D23 |
51.84 |
6.02 |
-8.82 |
0.16 |
0 |
|
|
367920 |
127326093 |
1 |
ON5C19H25 |
AB5C19D25 |
29.27 |
5.08 |
-8.9 |
0.11 |
0 |
|
|
367921 |
127326094 |
1 |
O2N3C23H33 |
A2B3C23D33 |
-93.21 |
5.55 |
-8.86 |
0.15 |
0 |
|
|
367922 |
127326096 |
1 |
ON5C19H25 |
AB5C19D25 |
16.31 |
5.02 |
-8.74 |
0.08 |
0 |
|
|
367923 |
127326097 |
1 |
N3O4C15H25 |
A3B4C15D25 |
-122.63 |
2.19 |
-9.17 |
-0.36 |
0 |
|
|
367924 |
127326098 |
1 |
N3O4C21H37 |
A3B4C21D37 |
-213.12 |
3.98 |
-9.04 |
0.98 |
0 |
|
|
367925 |
127326099 |
1 |
FO3N4C19H25 |
AB3C4D19E25 |
-83.71 |
2.71 |
-8.21 |
-0.31 |
0 |
|
|
367926 |
127326100 |
1 |
N3O3C22H39 |
A3B3C22D39 |
-166.52 |
6.26 |
-8.38 |
0.91 |
0 |
|
|
367927 |
127326101 |
1 |
N3O3C21H35 |
A3B3C21D35 |
-178.82 |
1.43 |
-8.99 |
0.23 |
0 |
|
|
367928 |
127326102 |
1 |
N3O3C22H39 |
A3B3C22D39 |
-169.26 |
5.62 |
-8.37 |
0.9 |
0 |
|
|
367929 |
127326103 |
1 |
ON5C23H25 |
AB5C23D25 |
49.28 |
6.34 |
-9.07 |
-0.99 |
0 |
|
|
367930 |
127326104 |
1 |
SO2N3C19H21 |
AB2C3D19E21 |
-22.05 |
8.76 |
-9.34 |
-0.57 |
0 |
|
|
367931 |
127326105 |
1 |
O2N3C21H31 |
A2B3C21D31 |
-94.74 |
2.34 |
-9.15 |
0.22 |
0 |
|
|
367932 |
127326106 |
1 |
FSO2N3C21H22 |
ABC2D3E21F22 |
-72.68 |
0.43 |
-8.56 |
-0.9 |
0 |
|
|
367933 |
127326107 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-27.55 |
1.6 |
-8.77 |
-0.35 |
0 |
|
|
367934 |
127326108 |
1 |
OSN4C20H26 |
ABC4D20E26 |
15.51 |
5.84 |
-8.8 |
0.04 |
0 |
|
|
367935 |
127326109 |
1 |
N2S2O3C18H26 |
A2B2C3D18E26 |
-112.19 |
4.44 |
-8.7 |
0.25 |
0 |
|
|
367936 |
127326110 |
1 |
O2N4C23H34 |
A2B4C23D34 |
-65.36 |
7.23 |
-8.68 |
-0.39 |
0 |
|
|
367937 |
127326111 |
1 |
ON4C22H30 |
AB4C22D30 |
-4.52 |
8.0 |
-8.47 |
-0.64 |
0 |
|
|
367938 |
127326112 |
1 |
ON5C23H37 |
AB5C23D37 |
-41.72 |
2.4 |
-8.05 |
0.0 |
0 |
|
|
367939 |
127326113 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-114.62 |
2.93 |
-8.43 |
0.15 |
0 |
|
|
367940 |
127326114 |
1 |
SO2N4C19H30 |
AB2C4D19E30 |
-83.12 |
3.24 |
-8.59 |
-0.3 |
0 |
|
|
367941 |
127326116 |
1 |
N3O3C21H31 |
A3B3C21D31 |
-113.92 |
4.48 |
-8.27 |
0.02 |
0 |
|
|
367942 |
127326117 |
1 |
OSN4C19H28 |
ABC4D19E28 |
-12.2 |
4.82 |
-8.45 |
-0.74 |
0 |
|
|
367943 |
127326118 |
1 |
ON2C17H32 |
AB2C17D32 |
-78.89 |
1.87 |
-8.14 |
2.26 |
0 |
|
|
367944 |
127326119 |
2 |
ON2C11H16 |
AB2C11D16 |
-77.17 |
1.95 |
-8.45 |
-0.32 |
0 |
|
|
367945 |
127326120 |
2 |
ON2C9H15 |
AB2C9D15 |
-47.95 |
5.92 |
-8.25 |
0.14 |
0 |
|
|
367946 |
127326129 |
1 |
ON2C17H32 |
AB2C17D32 |
-76.29 |
2.21 |
-8.17 |
2.51 |
0 |
|
|
367947 |
127326130 |
2 |
ON2C10H18 |
AB2C10D18 |
-124.57 |
5.5 |
-8.3 |
0.87 |
0 |
|
|
367948 |
127326131 |
1 |
SO2N4C19H28 |
AB2C4D19E28 |
-55.92 |
9.2 |
-8.66 |
-0.6 |
0 |
|
|
367949 |
127326132 |
2 |
N3C10H15 |
A3B10C15 |
82.95 |
6.88 |
-8.46 |
-0.9 |
0 |
|
|
367950 |
127326133 |
2 |
ON2C8H14 |
AB2C8D14 |
-99.11 |
1.9 |
-8.19 |
-0.05 |
0 |
|
|
367951 |
127326134 |
1 |
N2F3C13H23 |
A2B3C13D23 |
-186.14 |
3.55 |
-8.53 |
1.57 |
0 |
|
|
367952 |
127326135 |
2 |
ON2C10H18 |
AB2C10D18 |
-119.16 |
4.39 |
-8.22 |
0.86 |
0 |
|
|
367953 |
127326136 |
2 |
ON2C10H18 |
AB2C10D18 |
-123.94 |
3.96 |
-8.55 |
0.64 |
0 |
|
|
367954 |
127326137 |
1 |
O2N4C23H34 |
A2B4C23D34 |
-83.04 |
5.82 |
-8.44 |
-0.02 |
0 |
|
|
367955 |
127326138 |
1 |
ON5C18H31 |
AB5C18D31 |
-26.26 |
5.98 |
-8.6 |
0.4 |
0 |
|
|
367956 |
127326139 |
1 |
ON5C20H35 |
AB5C20D35 |
-40.52 |
6.23 |
-8.35 |
0.75 |
0 |
|
|
367957 |
127326140 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-110.32 |
6.02 |
-8.73 |
-1.28 |
0 |
|
|
367958 |
127326141 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-118.36 |
4.41 |
-8.26 |
0.02 |
0 |
|
|
367959 |
127326142 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-48.62 |
1.9 |
-8.56 |
0.02 |
0 |
|
|
367960 |
127326143 |
1 |
O2N4C21H38 |
A2B4C21D38 |
-128.33 |
2.27 |
-8.49 |
0.88 |
0 |
|
|
367961 |
127326144 |
1 |
ON5C21H37 |
AB5C21D37 |
-48.29 |
6.16 |
-8.57 |
0.48 |
0 |
|
|
367962 |
127326145 |
1 |
ON4C24H36 |
AB4C24D36 |
-35.03 |
3.67 |
-8.31 |
0.0 |
0 |
|
|
367963 |
127326169 |
1 |
ON5C18H29 |
AB5C18D29 |
-17.57 |
3.21 |
-8.45 |
-0.5 |
0 |
|
|
367964 |
127326170 |
1 |
N6C19H28 |
A6B19C28 |
87.56 |
6.81 |
-8.51 |
-0.94 |
0 |
|
|
367965 |
127326171 |
2 |
ON2C10H17 |
AB2C10D17 |
-61.25 |
6.76 |
-8.62 |
0.0 |
0 |
|
|
367966 |
127326172 |
1 |
O2N4C17H30 |
A2B4C17D30 |
-95.72 |
3.21 |
-8.61 |
0.15 |
0 |
|
|
367967 |
127326173 |
1 |
ON2C16H30 |
AB2C16D30 |
-72.84 |
2.07 |
-8.14 |
2.22 |
0 |
|
|
367968 |
127326174 |
1 |
O3N5C19H31 |
A3B5C19D31 |
-137.96 |
4.23 |
-7.98 |
-0.5 |
0 |
|
|
367969 |
127326189 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-114.4 |
5.14 |
-8.9 |
0.06 |
0 |
|
|
367970 |
127326190 |
1 |
N3O3C20H29 |
A3B3C20D29 |
-117.43 |
3.43 |
-8.92 |
0.12 |
0 |
|
|
367971 |
127326191 |
2 |
ON2C11H16 |
AB2C11D16 |
-55.24 |
4.66 |
-8.68 |
0.0 |
0 |
|
|
367972 |
127326213 |
1 |
SN2O3C20H26 |
AB2C3D20E26 |
-83.88 |
8.58 |
-8.92 |
-0.53 |
0 |
|
|
367973 |
127326214 |
1 |
S2N3O5C15H21 |
A2B3C5D15E21 |
-166.71 |
8.11 |
-9.05 |
-0.71 |
0 |
|
|
367974 |
127326215 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-157.68 |
5.99 |
-8.77 |
-0.72 |
0 |
|
|
367975 |
127326216 |
1 |
SN2O4C18H24 |
AB2C4D18E24 |
-128.9 |
7.86 |
-9.05 |
-0.65 |
0 |
|
|
367976 |
127326217 |
1 |
SN3O3C20H29 |
AB3C3D20E29 |
-119.43 |
7.85 |
-8.46 |
-0.43 |
0 |
|
|
367977 |
127326218 |
1 |
SN2O3C20H28 |
AB2C3D20E28 |
-105.96 |
8.91 |
-8.93 |
-0.49 |
0 |
|
|
367978 |
127326219 |
1 |
SN3O4C19H27 |
AB3C4D19E27 |
-169.64 |
7.79 |
-8.92 |
-0.51 |
0 |
|
|
367979 |
127326220 |
1 |
SN3O3C17H25 |
AB3C3D17E25 |
-115.91 |
8.98 |
-8.56 |
-0.6 |
0 |
|
|
367980 |
127326221 |
1 |
SN3O3C19H29 |
AB3C3D19E29 |
-111.17 |
11.24 |
-8.74 |
-0.52 |
0 |
|
|
367981 |
127326222 |
1 |
SN3O5C17H23 |
AB3C5D17E23 |
-189.15 |
3.99 |
-9.32 |
-1.05 |
0 |
|
|
367982 |
127326223 |
1 |
SN3O4C18H25 |
AB3C4D18E25 |
-163.58 |
8.37 |
-9.14 |
-0.77 |
0 |
|
|
367983 |
127326224 |
1 |
SN3O3C18H27 |
AB3C3D18E27 |
-117.54 |
8.71 |
-8.53 |
-0.56 |
0 |
|
|
367984 |
127326225 |
1 |
SN4O5C17H20 |
AB4C5D17E20 |
-177.86 |
9.64 |
-9.06 |
-0.61 |
0 |
|
|
367985 |
127326226 |
1 |
SN3O4C18H27 |
AB3C4D18E27 |
-147.68 |
8.02 |
-8.7 |
-0.48 |
0 |
|
|
367986 |
127326277 |
2 |
NOSC6H9 |
ABCD6E9 |
-52.92 |
4.01 |
-8.55 |
-0.25 |
0 |
|
|
367987 |
127326278 |
1 |
NS2O4C18H19 |
AB2C4D18E19 |
-101.26 |
6.41 |
-8.51 |
-0.63 |
0 |
|
|
367988 |
127326279 |
1 |
NS2O4C18H19 |
AB2C4D18E19 |
-102.51 |
7.22 |
-8.54 |
-0.59 |
0 |
|
|
367989 |
127326280 |
1 |
SN2O3C18H24 |
AB2C3D18E24 |
-80.31 |
4.44 |
-9.37 |
-0.78 |
0 |
|
|
367990 |
127326281 |
1 |
SO2N4C16H22 |
AB2C4D16E22 |
11.62 |
4.01 |
-9.37 |
-0.77 |
0 |
|
|
367991 |
127326373 |
2 |
ON3C10H11 |
AB3C10D11 |
-2.86 |
10.0 |
-9.2 |
-0.7 |
0 |