List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
367992 |
127326374 |
1 |
OS2N5C17H23 |
AB2C5D17E23 |
-4.55 |
6.13 |
-8.51 |
-0.36 |
0 |
|
|
367993 |
127326375 |
1 |
SO2N6C15H18 |
AB2C6D15E18 |
-19.71 |
1.24 |
-8.76 |
-0.91 |
0 |
|
|
367994 |
127326376 |
1 |
SO2N6C18H22 |
AB2C6D18E22 |
-30.91 |
2.27 |
-8.91 |
-0.68 |
0 |
|
|
367995 |
127326377 |
1 |
ON7C18H29 |
AB7C18D29 |
18.19 |
6.92 |
-8.76 |
0.54 |
0 |
|
|
367996 |
127326378 |
1 |
ON7C17H27 |
AB7C17D27 |
18.74 |
5.43 |
-8.78 |
0.42 |
0 |
|
|
367997 |
127326379 |
1 |
ON5C18H31 |
AB5C18D31 |
-38.7 |
5.6 |
-8.52 |
0.84 |
0 |
|
|
367998 |
127326380 |
1 |
ON5C17H29 |
AB5C17D29 |
-33.15 |
4.46 |
-8.7 |
0.89 |
0 |
|
|
367999 |
127326381 |
1 |
O2N5C15H25 |
A2B5C15D25 |
-39.14 |
3.0 |
-9.01 |
0.76 |
0 |
|
|
368000 |
127326382 |
1 |
ON7C17H27 |
AB7C17D27 |
33.74 |
3.01 |
-8.88 |
0.28 |
0 |
|
|
368001 |
127326383 |
1 |
ON6C16H22 |
AB6C16D22 |
35.09 |
5.98 |
-9.22 |
-0.07 |
0 |
|
|
368002 |
127326384 |
1 |
O3N5C20H27 |
A3B5C20D27 |
-50.75 |
3.97 |
-8.76 |
0.1 |
0 |
|
|
368003 |
127326385 |
1 |
ON5C17H29 |
AB5C17D29 |
-18.7 |
4.64 |
-8.92 |
0.81 |
0 |
|
|
368004 |
127326386 |
1 |
O2N3C13H25 |
A2B3C13D25 |
-98.45 |
2.03 |
-8.68 |
0.69 |
0 |
|
|
368005 |
127326387 |
1 |
SO2N5C17H29 |
AB2C5D17E29 |
-64.25 |
5.38 |
-8.57 |
-0.19 |
0 |
|
|
368006 |
127326388 |
1 |
SN4O4C16H26 |
AB4C4D16E26 |
-140.65 |
4.37 |
-8.83 |
-0.53 |
0 |
|
|
368007 |
127326389 |
1 |
ON4C16H18 |
AB4C16D18 |
10.89 |
2.93 |
-8.68 |
-0.69 |
0 |
|
|
368008 |
127326390 |
1 |
N2O3C13H24 |
A2B3C13D24 |
-138.27 |
4.46 |
-8.96 |
0.95 |
0 |
|
|
368009 |
127326484 |
1 |
O2N7C18H25 |
A2B7C18D25 |
-9.99 |
7.1 |
-9.55 |
-0.91 |
0 |
|
|
368010 |
127326485 |
1 |
O2N4C19H32 |
A2B4C19D32 |
-67.42 |
6.38 |
-8.55 |
0.22 |
0 |
|
|
368011 |
127326486 |
1 |
ON6C17H30 |
AB6C17D30 |
-26.08 |
4.32 |
-8.66 |
0.16 |
0 |
|
|
368012 |
127326487 |
1 |
FN2O3C22H25 |
AB2C3D22E25 |
-138.89 |
2.62 |
-8.94 |
-0.24 |
0 |
|
|
368013 |
127326500 |
1 |
O3N4C21H38 |
A3B4C21D38 |
-166.79 |
6.09 |
-9.21 |
0.59 |
0 |
|
|
368014 |
127326501 |
1 |
O3N4C21H34 |
A3B4C21D34 |
-119.88 |
4.33 |
-9.38 |
0.07 |
0 |
|
|
368015 |
127326502 |
1 |
ON4C18H28 |
AB4C18D28 |
-45.65 |
6.04 |
-9.72 |
-0.54 |
0 |
|
|
368016 |
127326503 |
1 |
O3N4C20H36 |
A3B4C20D36 |
-160.96 |
6.59 |
-9.1 |
0.7 |
0 |
|
|
368017 |
127326509 |
1 |
O2N6C19H24 |
A2B6C19D24 |
-26.65 |
6.49 |
-9.35 |
-0.63 |
0 |
|
|
368018 |
127326510 |
1 |
O2N6C17H24 |
A2B6C17D24 |
-0.22 |
5.15 |
-9.68 |
-1.02 |
0 |
|
|
368019 |
127326511 |
1 |
ON7C21H31 |
AB7C21D31 |
32.66 |
4.37 |
-8.64 |
-0.85 |
0 |
|
|
368020 |
127326512 |
1 |
ON6C16H20 |
AB6C16D20 |
56.12 |
3.55 |
-9.6 |
-0.79 |
0 |
|
|
368021 |
127326513 |
1 |
ON6C20H26 |
AB6C20D26 |
45.37 |
4.39 |
-9.53 |
-0.78 |
0 |
|
|
368022 |
127326514 |
2 |
ON4C9H11 |
AB4C9D11 |
63.74 |
3.73 |
-9.75 |
-1.03 |
0 |
|
|
368023 |
127326515 |
1 |
ON6C18H24 |
AB6C18D24 |
45.43 |
5.61 |
-9.58 |
-0.74 |
0 |
|
|
368024 |
127326516 |
2 |
ON3C10H14 |
AB3C10D14 |
-13.97 |
6.43 |
-9.68 |
-0.76 |
0 |
|
|
368025 |
127326517 |
1 |
SO3N6C14H18 |
AB3C6D14E18 |
-30.95 |
8.27 |
-10.19 |
-1.01 |
0 |
|
|
368026 |
127326518 |
1 |
O2N7C20H29 |
A2B7C20D29 |
0.35 |
3.44 |
-8.88 |
-0.82 |
0 |
|
|
368027 |
127326519 |
1 |
ON6C21H30 |
AB6C21D30 |
16.9 |
3.87 |
-9.56 |
-0.81 |
0 |
|
|
368028 |
127326624 |
1 |
ON4C22H26 |
AB4C22D26 |
-6.13 |
3.22 |
-8.54 |
-0.59 |
0 |
|
|
368029 |
127326625 |
1 |
O2N5C21H25 |
A2B5C21D25 |
-23.9 |
3.2 |
-8.81 |
-0.75 |
0 |
|
|
368030 |
127326626 |
1 |
ON5C21H27 |
AB5C21D27 |
5.51 |
2.64 |
-8.65 |
-0.65 |
0 |
|
|
368031 |
127326627 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-41.38 |
3.69 |
-8.67 |
-0.66 |
0 |
|
|
368032 |
127326628 |
1 |
ON5C23H31 |
AB5C23D31 |
-14.15 |
1.37 |
-8.7 |
-0.67 |
0 |
|
|
368033 |
127326629 |
1 |
SN4O4C17H26 |
AB4C4D17E26 |
-145.05 |
10.96 |
-9.08 |
-0.47 |
0 |
|
|
368034 |
127326630 |
1 |
SO3N5C15H25 |
AB3C5D15E25 |
-91.04 |
7.63 |
-9.1 |
0.64 |
0 |
|
|
368035 |
127326631 |
1 |
ON6C15H26 |
AB6C15D26 |
-10.5 |
4.01 |
-8.68 |
0.32 |
0 |
|
|
368036 |
127326632 |
1 |
SN3O3C13H25 |
AB3C3D13E25 |
-148.57 |
5.27 |
-8.67 |
0.56 |
0 |
|
|
368037 |
127326633 |
1 |
ON3C13H25 |
AB3C13D25 |
-66.49 |
3.75 |
-8.46 |
1.17 |
0 |
|
|
368038 |
127326634 |
1 |
SN3O3C16H29 |
AB3C3D16E29 |
-155.71 |
6.45 |
-8.76 |
0.59 |
0 |
|
|
368039 |
127326809 |
1 |
ON5C20H35 |
AB5C20D35 |
-41.75 |
4.65 |
-8.79 |
0.88 |
0 |
|
|
368040 |
127326810 |
1 |
FON5C22H30 |
ABC5D22E30 |
-23.33 |
2.73 |
-9.03 |
-0.09 |
0 |
|
|
368041 |
127326811 |
1 |
OSN6C16H24 |
ABC6D16E24 |
25.01 |
3.93 |
-8.82 |
-0.66 |
0 |
|
|
368042 |
127326812 |
1 |
N3O3C13H25 |
A3B3C13D25 |
-138.57 |
5.4 |
-9.1 |
1.0 |
0 |
|
|
368043 |
127326813 |
1 |
O3N4C21H32 |
A3B4C21D32 |
-113.78 |
4.2 |
-8.89 |
0.15 |
0 |
|
|
368044 |
127326814 |
1 |
O2N6C19H32 |
A2B6C19D32 |
-64.58 |
7.82 |
-8.96 |
0.79 |
0 |
|
|
368045 |
127326815 |
1 |
O2N4C17H32 |
A2B4C17D32 |
-117.29 |
4.24 |
-8.64 |
1.13 |
0 |
|
|
368046 |
127326816 |
1 |
O2N5C17H29 |
A2B5C17D29 |
-73.05 |
5.08 |
-8.52 |
0.87 |
0 |
|
|
368047 |
127327017 |
1 |
O2N4C13H14 |
A2B4C13D14 |
37.67 |
6.85 |
-9.4 |
-0.79 |
0 |
|
|
368048 |
127327018 |
1 |
O3N5C18H23 |
A3B5C18D23 |
-77.52 |
4.62 |
-9.51 |
-0.74 |
0 |
|
|
368049 |
127327019 |
1 |
SO3N4C19H22 |
AB3C4D19E22 |
-34.05 |
10.34 |
-9.02 |
-0.79 |
0 |
|
|
368050 |
127327020 |
1 |
ON3C18H23 |
AB3C18D23 |
2.95 |
6.81 |
-9.17 |
-0.46 |
0 |
|
|
368051 |
127327021 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-45.16 |
2.6 |
-9.2 |
-0.48 |
0 |
|
|
368052 |
127327022 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-45.68 |
2.43 |
-9.16 |
-0.58 |
0 |
|
|
368053 |
127327023 |
1 |
ON3C13H17 |
AB3C13D17 |
26.75 |
1.87 |
-9.34 |
-0.58 |
0 |
|
|
368054 |
127327024 |
1 |
SN3O3C18H27 |
AB3C3D18E27 |
-90.53 |
6.08 |
-9.25 |
-0.52 |
0 |
|
|
368055 |
127327025 |
1 |
ON3C17H17 |
AB3C17D17 |
48.25 |
7.11 |
-9.24 |
-0.52 |
0 |
|
|
368056 |
127327042 |
1 |
O3N4C18H22 |
A3B4C18D22 |
-74.07 |
3.57 |
-9.38 |
-0.62 |
0 |
|
|
368057 |
127327043 |
1 |
O2N5C13H13 |
A2B5C13D13 |
38.17 |
6.21 |
-9.46 |
-1.28 |
0 |
|
|
368058 |
127327128 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-29.02 |
5.45 |
-9.31 |
-0.56 |
0 |
|
|
368059 |
127327129 |
1 |
ON3C18H19 |
AB3C18D19 |
32.26 |
1.89 |
-9.29 |
-0.56 |
0 |
|
|
368060 |
127327130 |
1 |
ClO2N3H16C17 |
AB2C3D16E17 |
2.36 |
5.6 |
-9.03 |
-0.82 |
0 |
|
|
368061 |
127327131 |
1 |
ON5C14H17 |
AB5C14D17 |
56.03 |
4.84 |
-9.11 |
-0.84 |
0 |
|
|
368062 |
127327132 |
1 |
FO2N4C20H21 |
AB2C4D20E21 |
-40.94 |
3.86 |
-9.31 |
-0.66 |
0 |
|
|
368063 |
127327133 |
1 |
OSN3H15C16 |
ABC3D15E16 |
54.99 |
4.93 |
-8.82 |
-0.6 |
0 |
|
|
368064 |
127327134 |
2 |
ON2C7H8 |
AB2C7D8 |
24.39 |
4.82 |
-9.64 |
-0.93 |
0 |
|
|
368065 |
127327135 |
1 |
O3N5C18H23 |
A3B5C18D23 |
-66.81 |
6.32 |
-9.37 |
-0.57 |
0 |
|
|
368066 |
127327136 |
1 |
SO3N4C18H20 |
AB3C4D18E20 |
-43.52 |
5.1 |
-8.98 |
-0.7 |
0 |
|
|
368067 |
127327168 |
1 |
O3N4C19H26 |
A3B4C19D26 |
-124.74 |
2.13 |
-8.82 |
-0.26 |
0 |
|
|
368068 |
127327169 |
1 |
O2N3C23H33 |
A2B3C23D33 |
-93.76 |
3.88 |
-8.94 |
0.29 |
0 |
|
|
368069 |
127327170 |
1 |
SO2N3C21H29 |
AB2C3D21E29 |
-89.45 |
1.94 |
-8.78 |
0.0 |
0 |
|
|
368070 |
127327171 |
1 |
ON3C16H27 |
AB3C16D27 |
-41.94 |
5.91 |
-9.08 |
0.63 |
0 |
|
|
368071 |
127327172 |
1 |
N2O2C17H30 |
A2B2C17D30 |
-132.81 |
2.72 |
-9.05 |
0.86 |
0 |
|
|
368072 |
127327173 |
1 |
NO2C16H29 |
AB2C16D29 |
-132.47 |
5.73 |
-9.19 |
1.24 |
0 |
|
|
368073 |
127327174 |
1 |
ON3C16H27 |
AB3C16D27 |
-43.39 |
5.19 |
-9.08 |
0.34 |
0 |
|
|
368074 |
127327175 |
1 |
O2N3C19H25 |
A2B3C19D25 |
-14.34 |
4.48 |
-9.5 |
-1.21 |
0 |
|
|
368075 |
127327176 |
1 |
N3O3C22H39 |
A3B3C22D39 |
-172.22 |
2.24 |
-8.76 |
0.83 |
0 |
|
|
368076 |
127327177 |
1 |
NO3C15H27 |
AB3C15D27 |
-157.65 |
4.75 |
-9.18 |
0.95 |
0 |
|
|
368077 |
127327190 |
1 |
F2O2N3C20H25 |
A2B2C3D20E25 |
-153.29 |
6.04 |
-9.23 |
-0.4 |
0 |
|
|
368078 |
127327191 |
1 |
OS2N3C18H19 |
AB2C3D18E19 |
16.1 |
3.18 |
-8.8 |
-0.99 |
0 |
|
|
368079 |
127327192 |
1 |
N2S2O3C14H20 |
A2B2C3D14E20 |
-115.33 |
8.78 |
-9.83 |
-0.91 |
0 |
|
|
368080 |
127327193 |
1 |
SN2O3C20H24 |
AB2C3D20E24 |
-81.27 |
5.33 |
-8.49 |
-0.62 |
0 |
|
|
368081 |
127327286 |
1 |
OSF3N7C13H16 |
ABC3D7E13F16 |
-83.89 |
4.91 |
-9.38 |
-0.68 |
0 |
|
|
368082 |
127327287 |
1 |
SO2N4C17H24 |
AB2C4D17E24 |
-39.54 |
4.71 |
-8.86 |
0.12 |
0 |
|
|
368083 |
127327288 |
1 |
N4O4C21H24 |
A4B4C21D24 |
-85.91 |
10.63 |
-8.87 |
-0.2 |
0 |
|
|
368084 |
127327289 |
1 |
SO2N4C19H24 |
AB2C4D19E24 |
-23.51 |
7.26 |
-8.88 |
0.17 |
0 |
|
|
368085 |
127327455 |
1 |
ON5C18H27 |
AB5C18D27 |
-1.47 |
5.45 |
-8.77 |
0.06 |
0 |
|
|
368086 |
127327456 |
1 |
O2S2N5C16H21 |
A2B2C5D16E21 |
-2.96 |
5.61 |
-8.78 |
-1.11 |
0 |
|
|
368087 |
127327457 |
1 |
ON5C20H31 |
AB5C20D31 |
-18.88 |
3.68 |
-8.76 |
0.04 |
0 |
|
|
368088 |
127327458 |
1 |
ON4C15H24 |
AB4C15D24 |
-5.9 |
2.77 |
-8.91 |
0.12 |
0 |
|
|
368089 |
127327459 |
1 |
FSO2N4C19H23 |
ABC2D4E19F23 |
-60.41 |
4.58 |
-8.83 |
-1.1 |
0 |
|
|
368090 |
127327460 |
1 |
OSN7C16H21 |
ABC7D16E21 |
73.92 |
8.31 |
-8.81 |
-1.0 |
0 |
|
|
368091 |
127327467 |
1 |
ON4C17H28 |
AB4C17D28 |
-27.62 |
3.29 |
-8.82 |
0.02 |
0 |