List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
369067 |
127331208 |
1 |
OSN5C17H19 |
ABC5D17E19 |
52.06 |
8.7 |
-8.8 |
-0.49 |
0 |
|
|
369068 |
127331209 |
1 |
O2S2N3C16H17 |
A2B2C3D16E17 |
-20.14 |
2.19 |
-8.54 |
-0.67 |
0 |
|
|
369069 |
127331210 |
1 |
SO2N4C17H20 |
AB2C4D17E20 |
-11.6 |
4.56 |
-8.59 |
-0.44 |
0 |
|
|
369070 |
127331212 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-78.03 |
4.52 |
-8.59 |
-0.22 |
0 |
|
|
369071 |
127331213 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-85.15 |
5.04 |
-8.44 |
-0.02 |
0 |
|
|
369072 |
127331214 |
1 |
SN3O3C14H17 |
AB3C3D14E17 |
-101.21 |
3.24 |
-8.72 |
-0.37 |
0 |
|
|
369073 |
127331215 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-58.48 |
3.8 |
-8.61 |
-0.25 |
0 |
|
|
369074 |
127331216 |
1 |
SN3O3C18H23 |
AB3C3D18E23 |
-106.92 |
4.88 |
-8.64 |
-0.27 |
0 |
|
|
369075 |
127331217 |
1 |
SN2O2C15H20 |
AB2C2D15E20 |
-79.78 |
4.05 |
-8.57 |
-0.13 |
0 |
|
|
369076 |
127331218 |
1 |
SN2O2C15H20 |
AB2C2D15E20 |
-85.81 |
3.43 |
-8.52 |
-0.15 |
0 |
|
|
369077 |
127331219 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-73.89 |
2.89 |
-8.6 |
-0.16 |
0 |
|
|
369078 |
127331220 |
1 |
SO2N3C14H17 |
AB2C3D14E17 |
-63.99 |
1.4 |
-8.65 |
-0.32 |
0 |
|
|
369079 |
127331236 |
1 |
S2N3O3C15H21 |
A2B3C3D15E21 |
-106.66 |
6.13 |
-8.59 |
-0.25 |
0 |
|
|
369080 |
127331237 |
1 |
S2N3O3C17H25 |
A2B3C3D17E25 |
-116.0 |
3.73 |
-8.54 |
-0.15 |
0 |
|
|
369081 |
127331238 |
1 |
OSN4C18H22 |
ABC4D18E22 |
11.35 |
2.1 |
-8.59 |
-0.22 |
0 |
|
|
369082 |
127331239 |
1 |
OSN4C19H24 |
ABC4D19E24 |
-6.07 |
7.61 |
-8.55 |
-0.22 |
0 |
|
|
369083 |
127331240 |
1 |
OSN4C17H20 |
ABC4D17E20 |
1.36 |
3.0 |
-8.66 |
-0.28 |
0 |
|
|
369084 |
127331241 |
1 |
SN2O3C15H20 |
AB2C3D15E20 |
-122.39 |
3.1 |
-8.61 |
-0.26 |
0 |
|
|
369085 |
127331242 |
1 |
OSN3C15H17 |
ABC3D15E17 |
2.39 |
3.64 |
-8.62 |
-0.25 |
0 |
|
|
369086 |
127331243 |
1 |
SN2O2C14H18 |
AB2C2D14E18 |
-64.53 |
3.62 |
-8.56 |
-0.19 |
0 |
|
|
369087 |
127331244 |
1 |
SN2O2C15H20 |
AB2C2D15E20 |
-75.19 |
4.69 |
-8.57 |
-0.21 |
0 |
|
|
369088 |
127331245 |
1 |
S2N3O3C15H21 |
A2B3C3D15E21 |
-106.63 |
6.24 |
-8.47 |
-0.07 |
0 |
|
|
369089 |
127331246 |
1 |
SO2N3C15H19 |
AB2C3D15E19 |
-72.32 |
5.22 |
-8.48 |
-0.1 |
0 |
|
|
369090 |
127331249 |
1 |
S2N3O3C17H25 |
A2B3C3D17E25 |
-115.08 |
7.04 |
-8.52 |
-0.17 |
0 |
|
|
369091 |
127331250 |
1 |
OSN5C17H21 |
ABC5D17E21 |
17.6 |
4.66 |
-8.65 |
-0.33 |
0 |
|
|
369092 |
127331251 |
1 |
OSN5C17H19 |
ABC5D17E19 |
37.5 |
2.36 |
-8.62 |
-0.51 |
0 |
|
|
369093 |
127331252 |
1 |
SO2N3C20H27 |
AB2C3D20E27 |
-82.61 |
0.81 |
-8.61 |
-0.26 |
0 |
|
|
369094 |
127331253 |
1 |
SO2N3C17H19 |
AB2C3D17E19 |
-10.36 |
0.91 |
-8.64 |
-0.2 |
0 |
|
|
369095 |
127331254 |
1 |
SO3N4C19H26 |
AB3C4D19E26 |
-99.92 |
5.01 |
-8.68 |
-0.32 |
0 |
|
|
369096 |
127331256 |
1 |
SN2O2C15H20 |
AB2C2D15E20 |
-88.35 |
2.73 |
-8.55 |
-0.16 |
0 |
|
|
369097 |
127331257 |
1 |
OSN4C16H16 |
ABC4D16E16 |
21.76 |
4.53 |
-8.7 |
-0.66 |
0 |
|
|
369098 |
127331258 |
1 |
OSN4C17H20 |
ABC4D17E20 |
17.58 |
0.98 |
-8.59 |
-0.19 |
0 |
|
|
369099 |
127331259 |
1 |
SO2N4C18H26 |
AB2C4D18E26 |
-72.6 |
4.74 |
-8.65 |
-0.3 |
0 |
|
|
369100 |
127331260 |
1 |
SO2N3C18H25 |
AB2C3D18E25 |
-80.68 |
0.72 |
-8.61 |
-0.28 |
0 |
|
|
369101 |
127331261 |
1 |
SO2N3C22H25 |
AB2C3D22E25 |
-44.58 |
5.02 |
-8.6 |
-0.25 |
0 |
|
|
369102 |
127331262 |
1 |
OSN3C14H19 |
ABC3D14E19 |
-19.88 |
3.74 |
-8.55 |
-0.19 |
0 |
|
|
369103 |
127331263 |
1 |
SO2N4C20H28 |
AB2C4D20E28 |
-69.05 |
6.27 |
-8.46 |
-0.11 |
0 |
|
|
369104 |
127331264 |
1 |
OSN3C15H21 |
ABC3D15E21 |
-20.84 |
2.33 |
-8.56 |
-0.12 |
0 |
|
|
369105 |
127331265 |
1 |
ON6C18H24 |
AB6C18D24 |
30.15 |
3.44 |
-8.89 |
-0.89 |
0 |
|
|
369106 |
127331266 |
1 |
ON6C22H32 |
AB6C22D32 |
16.58 |
3.64 |
-8.9 |
-0.84 |
0 |
|
|
369107 |
127331276 |
2 |
ON2C11H12 |
AB2C11D12 |
-0.64 |
7.18 |
-8.71 |
-1.04 |
0 |
|
|
369108 |
127331277 |
1 |
SO2N3C19H19 |
AB2C3D19E19 |
3.33 |
7.49 |
-8.89 |
-0.92 |
0 |
|
|
369109 |
127331278 |
1 |
O2N3C19H25 |
A2B3C19D25 |
-46.16 |
6.83 |
-9.04 |
-0.86 |
0 |
|
|
369110 |
127331279 |
1 |
NSO2C14H17 |
ABC2D14E17 |
-65.15 |
2.64 |
-8.5 |
0.0 |
0 |
|
|
369111 |
127331286 |
1 |
O2N5C19H23 |
A2B5C19D23 |
11.2 |
11.5 |
-8.79 |
-0.62 |
0 |
|
|
369112 |
127331287 |
1 |
O2N3C19H19 |
A2B3C19D19 |
-17.4 |
8.19 |
-8.94 |
-0.69 |
0 |
|
|
369113 |
127331288 |
1 |
O3N4C14H16 |
A3B4C14D16 |
-75.7 |
6.06 |
-8.95 |
-0.8 |
0 |
|
|
369114 |
127331289 |
1 |
O3N4C18H22 |
A3B4C18D22 |
-82.6 |
4.77 |
-9.2 |
-0.95 |
0 |
|
|
369115 |
127331299 |
1 |
N3O4C15H19 |
A3B4C15D19 |
-118.78 |
5.45 |
-9.12 |
-0.89 |
0 |
|
|
369116 |
127331304 |
3 |
NOC6H7 |
ABC6D7 |
-79.5 |
4.32 |
-9.14 |
-0.88 |
0 |
|
|
369117 |
127331305 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-83.07 |
8.53 |
-8.86 |
-0.64 |
0 |
|
|
369118 |
127331306 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-84.94 |
8.25 |
-9.05 |
-0.77 |
0 |
|
|
369119 |
127331307 |
1 |
SO2N3C14H17 |
AB2C3D14E17 |
-37.2 |
7.6 |
-8.64 |
-0.82 |
0 |
|
|
369120 |
127331308 |
1 |
O3N5C19H19 |
A3B5C19D19 |
5.66 |
4.16 |
-9.35 |
-1.43 |
0 |
|
|
369121 |
127331309 |
1 |
O4N5C20H25 |
A4B5C20D25 |
-133.92 |
8.42 |
-8.95 |
-0.82 |
0 |
|
|
369122 |
127331310 |
1 |
SN3O3H15C16 |
AB3C3D15E16 |
-39.96 |
8.29 |
-9.02 |
-1.26 |
0 |
|
|
369123 |
127331346 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-29.51 |
6.96 |
-9.08 |
-0.9 |
0 |
|
|
369124 |
127331347 |
2 |
ON2C11H12 |
AB2C11D12 |
4.83 |
6.45 |
-8.36 |
-0.93 |
0 |
|
|
369125 |
127331348 |
1 |
O3N5C19H21 |
A3B5C19D21 |
-15.77 |
6.83 |
-9.21 |
-1.02 |
0 |
|
|
369126 |
127331358 |
1 |
O2N3C23H25 |
A2B3C23D25 |
-19.87 |
5.94 |
-8.63 |
-0.82 |
0 |
|
|
369127 |
127331359 |
1 |
O2N3C15H17 |
A2B3C15D17 |
1.58 |
7.9 |
-9.02 |
-0.81 |
0 |
|
|
369128 |
127331360 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-30.19 |
6.83 |
-8.55 |
-0.93 |
0 |
|
|
369129 |
127331361 |
2 |
ON2C11H15 |
AB2C11D15 |
-44.43 |
7.41 |
-8.38 |
-0.92 |
0 |
|
|
369130 |
127331362 |
1 |
O2N3C21H25 |
A2B3C21D25 |
-43.16 |
6.57 |
-8.96 |
-0.83 |
0 |
|
|
369131 |
127331363 |
2 |
N2O2C9H11 |
A2B2C9D11 |
-114.89 |
7.14 |
-9.13 |
-1.09 |
0 |
|
|
369132 |
127331364 |
1 |
SO2N3C17H19 |
AB2C3D17E19 |
-21.4 |
3.71 |
-8.81 |
-0.34 |
0 |
|
|
369133 |
127331365 |
1 |
NSO2C14H17 |
ABC2D14E17 |
-61.48 |
5.11 |
-8.41 |
-0.02 |
0 |
|
|
369134 |
127331366 |
1 |
O2N3C19H23 |
A2B3C19D23 |
4.58 |
6.36 |
-9.08 |
-0.88 |
0 |
|
|
369135 |
127331367 |
1 |
SN4O4C18H24 |
AB4C4D18E24 |
-122.42 |
8.15 |
-9.16 |
-0.94 |
0 |
|
|
369136 |
127331368 |
1 |
N3O3C17H21 |
A3B3C17D21 |
-80.81 |
7.5 |
-9.24 |
-1.07 |
0 |
|
|
369137 |
127331369 |
1 |
FO2N3H22C23 |
AB2C3D22E23 |
-55.87 |
8.38 |
-8.65 |
-1.08 |
0 |
|
|
369138 |
127331370 |
3 |
NOC7H9 |
ABC7D9 |
-88.14 |
7.46 |
-9.04 |
-0.83 |
0 |
|
|
369139 |
127331372 |
1 |
O2N5C22H27 |
A2B5C22D27 |
-14.61 |
8.6 |
-8.61 |
-1.09 |
0 |
|
|
369140 |
127331373 |
1 |
O2N3C22H23 |
A2B3C22D23 |
-8.97 |
7.56 |
-9.07 |
-0.86 |
0 |
|
|
369141 |
127331374 |
1 |
NSO2C15H19 |
ABC2D15E19 |
-68.15 |
3.13 |
-8.49 |
0.01 |
0 |