List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
120862 |
50747150 |
2 |
NOC10H12 |
ABC10D12 |
-48.85 |
5.22 |
-8.98 |
0.02 |
0 |
|
|
120863 |
50747192 |
2 |
NOC10H12 |
ABC10D12 |
-51.03 |
4.42 |
-8.99 |
0.06 |
0 |
|
|
120864 |
50747193 |
1 |
OF2N2C18H18 |
AB2C2D18E18 |
-101.35 |
5.08 |
-8.9 |
-0.24 |
0 |
|
|
120865 |
50747257 |
1 |
FNOC19H20 |
ABCD19E20 |
-62.73 |
3.27 |
-9.21 |
0.01 |
0 |
|
|
120866 |
50747258 |
1 |
FNOC19H20 |
ABCD19E20 |
-62.45 |
6.23 |
-9.35 |
0.0 |
0 |
|
|
120867 |
50747267 |
1 |
ClO3N4H23C26 |
AB3C4D23E26 |
-56.01 |
4.72 |
-8.62 |
-1.36 |
0 |
|
|
120868 |
50747268 |
1 |
ClO3N4H25C27 |
AB3C4D25E27 |
-67.23 |
5.1 |
-8.74 |
-1.57 |
0 |
|
|
120869 |
50747322 |
1 |
N2O2H20C21 |
A2B2C20D21 |
19.15 |
4.87 |
-9.3 |
-0.82 |
0 |
|
|
120870 |
50747588 |
1 |
SN3O4C12H15 |
AB3C4D12E15 |
-80.52 |
4.76 |
-9.79 |
-1.11 |
0 |
|
|
120871 |
50747617 |
1 |
SN4O5C21H24 |
AB4C5D21E24 |
-111.12 |
8.96 |
-8.2 |
-1.07 |
0 |
|
|
120872 |
50747632 |
1 |
SN3O5C19H21 |
AB3C5D19E21 |
-95.98 |
5.34 |
-8.49 |
-1.08 |
0 |
|
|
120873 |
50747708 |
1 |
O3N7H13C17 |
A3B7C13D17 |
136.26 |
9.13 |
-8.79 |
-2.59 |
0 |
|
|
120874 |
50748257 |
1 |
O3N4C18H26 |
A3B4C18D26 |
-85.1 |
5.11 |
-9.07 |
-0.49 |
0 |
|
|
120875 |
50748261 |
1 |
FO3N5C25H30 |
AB3C5D25E30 |
-78.86 |
2.88 |
-8.87 |
-0.58 |
0 |
|
|
120876 |
50748262 |
1 |
FON3C22H26 |
ABC3D22E26 |
-41.37 |
2.88 |
-8.19 |
-0.03 |
0 |
|
|
120877 |
50748263 |
1 |
O3N5C20H23 |
A3B5C20D23 |
-38.77 |
6.21 |
-8.96 |
-0.58 |
0 |
|
|
120878 |
50748286 |
1 |
O3N4C23H28 |
A3B4C23D28 |
-60.97 |
7.85 |
-8.59 |
-0.82 |
0 |
|
|
120879 |
50748299 |
1 |
SO3N5C18H21 |
AB3C5D18E21 |
-36.11 |
6.22 |
-8.95 |
-0.74 |
0 |
|
|
120880 |
50748300 |
1 |
O3N4C22H26 |
A3B4C22D26 |
-51.17 |
7.57 |
-9.22 |
-0.74 |
0 |
|
|
120881 |
50748301 |
1 |
O4N5C22H25 |
A4B5C22D25 |
-91.36 |
9.08 |
-8.43 |
-0.65 |
0 |
|
|
120882 |
50748373 |
1 |
BrON5C20H24 |
ABC5D20E24 |
14.17 |
3.26 |
-8.7 |
-0.59 |
0 |
|
|
120883 |
50748420 |
1 |
FON5C22H22 |
ABC5D22E22 |
-15.05 |
5.82 |
-8.42 |
-0.82 |
0 |
|
|
120884 |
50748427 |
1 |
BrSO2N5C17H22 |
ABC2D5E17F22 |
-17.5 |
2.19 |
-8.64 |
-1.07 |
0 |
|
|
120885 |
50748450 |
1 |
ON5C24H27 |
AB5C24D27 |
15.21 |
7.57 |
-8.32 |
-0.47 |
0 |
|
|
120886 |
50748488 |
1 |
ON5C18H29 |
AB5C18D29 |
-37.08 |
2.19 |
-8.64 |
0.35 |
0 |
|
|
120887 |
50748666 |
1 |
SO3N5H15C18 |
AB3C5D15E18 |
31.81 |
9.98 |
-8.42 |
-1.84 |
0 |
|
|
120888 |
50748869 |
1 |
ON5C17H19 |
AB5C17D19 |
46.28 |
3.93 |
-8.94 |
-0.95 |
0 |
|
|
120889 |
50749008 |
1 |
ClFON5H17C21 |
ABCD5E17F21 |
31.13 |
8.17 |
-8.83 |
-1.07 |
0 |
|
|
120890 |
50749023 |
1 |
O4N5H19C20 |
A4B5C19D20 |
-26.08 |
1.79 |
-8.81 |
-1.04 |
0 |
|
|
120891 |
50749135 |
1 |
ON5H21C22 |
AB5C21D22 |
74.44 |
7.18 |
-9.16 |
-0.92 |
0 |
|
|
120892 |
50749279 |
1 |
ClO2N3C20H20 |
AB2C3D20E20 |
-47.84 |
8.8 |
-8.79 |
-1.21 |
0 |
|
|
120893 |
50749327 |
1 |
N3O4C22H23 |
A3B4C22D23 |
-132.04 |
5.85 |
-9.02 |
-0.95 |
0 |
|
|
120894 |
50749328 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-59.31 |
4.48 |
-8.74 |
-0.77 |
0 |
|
|
120895 |
50749329 |
1 |
ClN3O4C23H26 |
AB3C4D23E26 |
-131.3 |
10.24 |
-8.17 |
-0.82 |
0 |
|
|
120896 |
50749334 |
1 |
N3O4C25H29 |
A3B4C25D29 |
-155.58 |
6.79 |
-8.74 |
-0.82 |
0 |
|
|
120897 |
50749433 |
1 |
F2O2N3H15C18 |
A2B2C3D15E18 |
-120.65 |
1.18 |
-9.18 |
-1.07 |
0 |
|
|
120898 |
50749525 |
1 |
ClO2N3H18C19 |
AB2C3D18E19 |
-46.82 |
4.04 |
-8.88 |
-0.88 |
0 |
|
|
120899 |
50749592 |
1 |
N3O3C19H19 |
A3B3C19D19 |
-84.94 |
3.74 |
-9.39 |
-1.07 |
0 |
|
|
120900 |
50749608 |
1 |
OF3N5H18C22 |
AB3C5D18E22 |
-91.46 |
1.94 |
-8.81 |
-1.34 |
0 |
|
|
120901 |
50749713 |
1 |
SF2N3O3H13C18 |
AB2C3D3E13F18 |
-122.7 |
4.33 |
-9.53 |
-1.3 |
0 |
|
|
120902 |
50749757 |
1 |
FSN3O4H16C19 |
ABC3D4E16F19 |
-112.64 |
7.43 |
-9.03 |
-1.06 |
0 |
|
|
120903 |
50749790 |
1 |
SN3O4C13H13 |
AB3C4D13E13 |
-95.72 |
7.06 |
-9.12 |
-0.85 |
0 |
|
|
120904 |
50749861 |
1 |
ClSN3O5H18C21 |
ABC3D5E18F21 |
-129.57 |
4.03 |
-9.6 |
-1.42 |
0 |
|
|
120905 |
50749920 |
1 |
ON5C20H23 |
AB5C20D23 |
36.55 |
8.16 |
-8.8 |
-0.73 |
0 |
|
|
120906 |
50749921 |
1 |
O2N5C20H23 |
A2B5C20D23 |
1.78 |
6.09 |
-8.9 |
-0.86 |
0 |
|
|
120907 |
50749991 |
1 |
ON5C24H31 |
AB5C24D31 |
15.37 |
8.06 |
-8.82 |
-0.76 |
0 |
|
|
120908 |
50749992 |
1 |
ON5C23H29 |
AB5C23D29 |
22.34 |
8.04 |
-8.82 |
-0.76 |
0 |
|
|
120909 |
50749993 |
1 |
O2N5C27H31 |
A2B5C27D31 |
5.12 |
3.9 |
-8.55 |
-0.89 |
0 |
|
|
120910 |
50750176 |
1 |
ON6C22H22 |
AB6C22D22 |
72.69 |
9.19 |
-8.96 |
-1.24 |
0 |
|
|
120911 |
50750177 |
1 |
OSN5C17H19 |
ABC5D17E19 |
52.11 |
9.09 |
-8.89 |
-0.94 |
0 |
|
|
120912 |
50750477 |
1 |
O2N5C20H23 |
A2B5C20D23 |
0.07 |
3.53 |
-8.54 |
-0.84 |
0 |
|
|
120913 |
50750481 |
1 |
SO3N4C15H22 |
AB3C4D15E22 |
-80.85 |
6.69 |
-8.44 |
-0.34 |
0 |
|
|
120914 |
50750635 |
1 |
SO3N4C24H24 |
AB3C4D24E24 |
-29.26 |
2.97 |
-8.3 |
-0.9 |
0 |
|
|
120915 |
50750645 |
2 |
ON3C10H12 |
AB3C10D12 |
0.26 |
8.19 |
-8.99 |
-0.62 |
0 |
|
|
120916 |
50750676 |
1 |
ClFO2N5H15C20 |
ABC2D5E15F20 |
-21.08 |
3.96 |
-9.28 |
-0.98 |
0 |
|
|
120917 |
50750740 |
1 |
ClO2N5H20C22 |
AB2C5D20E22 |
10.83 |
4.78 |
-9.07 |
-1.03 |
0 |
|
|
120918 |
50750766 |
1 |
SO2N4C24H24 |
AB2C4D24E24 |
10.29 |
3.9 |
-8.5 |
-0.98 |
0 |
|
|
120919 |
50750793 |
1 |
ClSO2N6C23H23 |
ABC2D6E23F23 |
16.48 |
3.88 |
-8.84 |
-1.22 |
0 |
|
|
120920 |
50750822 |
1 |
ClO3N6C23H23 |
AB3C6D23E23 |
-20.58 |
7.36 |
-8.68 |
-1.2 |
0 |
|
|
120921 |
50750823 |
1 |
ClFO3N6H22C23 |
ABC3D6E22F23 |
-64.34 |
4.68 |
-8.81 |
-1.28 |
0 |
|
|
120922 |
50750824 |
1 |
O3N6H26C28 |
A3B6C26D28 |
16.51 |
5.33 |
-8.64 |
-1.18 |
0 |
|
|
120923 |
50750860 |
1 |
ON5H25C28 |
AB5C25D28 |
75.83 |
3.22 |
-8.09 |
-0.14 |
0 |
|
|
120924 |
50750861 |
1 |
ON5H25C28 |
AB5C25D28 |
71.78 |
5.66 |
-8.14 |
-0.46 |
0 |
|
|
120925 |
50750873 |
1 |
FON5H24C28 |
ABC5D24E28 |
25.91 |
4.17 |
-8.27 |
-0.6 |
0 |
|
|
120926 |
50750874 |
1 |
FON5H24C28 |
ABC5D24E28 |
25.59 |
4.99 |
-8.09 |
-0.56 |
0 |
|
|
120927 |
50750875 |
1 |
O2N5H27C29 |
A2B5C27D29 |
33.17 |
4.21 |
-8.1 |
-0.59 |
0 |
|
|
120928 |
50750876 |
1 |
O2N5H27C29 |
A2B5C27D29 |
30.9 |
6.21 |
-7.94 |
-0.43 |
0 |
|
|
120929 |
50750877 |
1 |
ON4C22H26 |
AB4C22D26 |
6.86 |
5.76 |
-7.9 |
0.0 |
0 |
|
|
120930 |
50750909 |
1 |
SO2N4C25H26 |
AB2C4D25E26 |
12.99 |
3.51 |
-8.57 |
-0.76 |
0 |
|
|
120931 |
50750910 |
1 |
SO3N4C21H24 |
AB3C4D21E24 |
-51.13 |
4.39 |
-8.51 |
-0.82 |
0 |
|
|
120932 |
50750975 |
1 |
ClSO2N4C17H17 |
ABC2D4E17F17 |
-20.17 |
5.89 |
-8.84 |
-0.93 |
0 |
|
|
120933 |
50751053 |
1 |
FOSN6H21C24 |
ABCD6E21F24 |
46.47 |
4.91 |
-9.13 |
-1.15 |
0 |
|
|
120934 |
50751132 |
1 |
ON4C17H22 |
AB4C17D22 |
-2.9 |
1.35 |
-8.8 |
-0.56 |
0 |
|
|
120935 |
50751133 |
1 |
O2N4C23H24 |
A2B4C23D24 |
6.34 |
2.4 |
-8.76 |
-0.56 |
0 |
|
|
120936 |
50751134 |
2 |
OSN4C10H11 |
ABC4D10E11 |
42.4 |
8.68 |
-9.12 |
-0.98 |
0 |
|
|
120937 |
50751154 |
1 |
SO2N8H22C23 |
AB2C8D22E23 |
46.91 |
7.38 |
-8.96 |
-1.32 |
0 |
|
|
120938 |
50751155 |
1 |
ON4C22H22 |
AB4C22D22 |
48.71 |
2.31 |
-9.25 |
-0.68 |
0 |
|
|
120939 |
50751164 |
1 |
ON4C14H18 |
AB4C14D18 |
3.54 |
1.07 |
-8.82 |
-0.61 |
0 |
|
|
120940 |
50751239 |
1 |
SN3O3C24H27 |
AB3C3D24E27 |
-65.65 |
4.34 |
-8.99 |
-0.74 |
0 |
|
|
120941 |
50751368 |
1 |
SN3O3C25H29 |
AB3C3D25E29 |
-73.54 |
4.38 |
-9.15 |
-0.61 |
0 |
|
|
120942 |
50751667 |
1 |
SN4O4C24H28 |
AB4C4D24E28 |
-75.26 |
9.0 |
-8.98 |
-0.55 |
0 |
|
|
120943 |
50751677 |
1 |
SN4O4C20H22 |
AB4C4D20E22 |
-78.74 |
10.61 |
-9.18 |
-0.63 |
0 |
|
|
120944 |
50751688 |
1 |
SN4O4C19H20 |
AB4C4D19E20 |
-83.54 |
3.25 |
-8.74 |
-0.66 |
0 |
|
|
120945 |
50751689 |
1 |
SN4O4C19H26 |
AB4C4D19E26 |
-120.78 |
4.03 |
-9.12 |
-0.67 |
0 |
|
|
120946 |
50751690 |
1 |
SN4O4C20H28 |
AB4C4D20E28 |
-127.37 |
3.55 |
-9.04 |
-0.6 |
0 |
|
|
120947 |
50751691 |
1 |
SN4O4C21H24 |
AB4C4D21E24 |
-84.54 |
5.4 |
-8.8 |
-0.68 |
0 |
|
|
120948 |
50751692 |
1 |
SN4O4C21H24 |
AB4C4D21E24 |
-89.69 |
3.46 |
-8.91 |
-0.64 |
0 |
|
|
120949 |
50751693 |
1 |
SO4N5C20H27 |
AB4C5D20E27 |
-97.11 |
3.76 |
-8.84 |
-0.52 |
0 |
|
|
120950 |
50751694 |
1 |
SN4O5C22H24 |
AB4C5D22E24 |
-108.89 |
10.4 |
-8.59 |
-0.73 |
0 |
|
|
120951 |
50751695 |
1 |
SN4O4C24H26 |
AB4C4D24E26 |
-78.09 |
4.69 |
-8.78 |
-0.55 |
0 |
|
|
120952 |
50751696 |
1 |
SN4O5C23H26 |
AB4C5D23E26 |
-120.13 |
3.7 |
-9.12 |
-0.66 |
0 |
|
|
120953 |
50751697 |
1 |
SN2O3C20H22 |
AB2C3D20E22 |
-72.6 |
4.4 |
-9.2 |
-0.12 |
0 |
|
|
120954 |
50751698 |
1 |
ClSN2O3C21H23 |
ABC2D3E21F23 |
-91.07 |
3.91 |
-9.28 |
-0.37 |
0 |
|
|
120955 |
50751699 |
1 |
N3O3C28H29 |
A3B3C28D29 |
-47.34 |
5.09 |
-8.65 |
-0.58 |
0 |
|
|
120956 |
50751721 |
1 |
SN4O4C22H24 |
AB4C4D22E24 |
-76.41 |
3.72 |
-9.01 |
-0.52 |
0 |
|
|
120957 |
50751722 |
1 |
SN4O4C20H26 |
AB4C4D20E26 |
-116.58 |
4.06 |
-8.96 |
-0.51 |
0 |
|
|
120958 |
50751723 |
1 |
SN4O4C22H30 |
AB4C4D22E30 |
-117.75 |
11.23 |
-8.97 |
-0.57 |
0 |
|
|
120959 |
50751724 |
1 |
SN4O4C22H30 |
AB4C4D22E30 |
-123.18 |
4.12 |
-9.0 |
-0.49 |
0 |
|
|
120960 |
50751842 |
1 |
ClSO2N5H20C22 |
ABC2D5E20F22 |
50.34 |
6.75 |
-9.09 |
-1.01 |
0 |
|
|
120961 |
50751867 |
1 |
FN3O3H16C18 |
AB3C3D16E18 |
-54.09 |
4.78 |
-9.13 |
-1.18 |
0 |