List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
323085 |
126672193 |
1 |
N3C17H33 |
A3B17C33 |
-23.25 |
3.54 |
-9.22 |
1.07 |
0 |
|
|
323086 |
126672195 |
1 |
SN2C7H12 |
AB2C7D12 |
7.05 |
1.91 |
-9.03 |
-0.08 |
0 |
|
|
323087 |
126672204 |
1 |
ON2C7H12 |
AB2C7D12 |
-32.13 |
2.28 |
-9.21 |
0.98 |
0 |
|
|
323088 |
126672216 |
1 |
NSO3F4C18H25 |
ABC3D4E18F25 |
-318.76 |
2.8 |
-8.68 |
-0.28 |
0 |
|
|
323089 |
126672241 |
1 |
NOC15H31 |
ABC15D31 |
-105.9 |
1.86 |
-8.51 |
2.48 |
0 |
|
|
323090 |
126672256 |
1 |
FON6H17C21 |
ABC6D17E21 |
55.59 |
4.78 |
-8.41 |
-1.31 |
0 |
|
|
323091 |
126672267 |
1 |
NOC9H11 |
ABC9D11 |
17.75 |
5.96 |
-10.04 |
1.63 |
0 |
|
|
323092 |
126672274 |
1 |
FO4N7C29H30 |
AB4C7D29E30 |
-80.68 |
5.34 |
-8.54 |
-1.37 |
0 |
|
|
323093 |
126672285 |
2 |
NOC10H11 |
ABC10D11 |
-51.65 |
4.42 |
-8.49 |
-0.16 |
0 |
|
|
323094 |
126672302 |
1 |
NOC16H19 |
ABC16D19 |
-10.54 |
3.13 |
-8.21 |
0.02 |
0 |
|
|
323095 |
126672311 |
1 |
NOC7H15 |
ABC7D15 |
-65.75 |
1.27 |
-8.72 |
2.52 |
0 |
|
|
323096 |
126672379 |
1 |
Cl2O2N3H13C16 |
A2B2C3D13E16 |
-21.98 |
3.4 |
-9.04 |
-0.75 |
0 |
|
|
323097 |
126672398 |
2 |
NC10H21 |
AB10C21 |
-70.95 |
2.49 |
-8.47 |
2.72 |
0 |
|
|
323098 |
126672401 |
1 |
NOH11C13 |
ABC11D13 |
-1.48 |
2.9 |
-8.32 |
-0.45 |
0 |
|
|
323099 |
126672447 |
2 |
OC8H8 |
AB8C8 |
-24.68 |
6.01 |
-9.36 |
-1.58 |
0 |
|
|
323100 |
126672448 |
1 |
ClO2H17C20 |
AB2C17D20 |
-32.03 |
1.59 |
-9.01 |
-0.39 |
0 |
|
|
323101 |
126672467 |
1 |
NO2C19H21 |
AB2C19D21 |
-25.79 |
0.99 |
-8.65 |
-0.17 |
0 |
|
|
323102 |
126672472 |
1 |
O2N3C20H21 |
A2B3C20D21 |
10.4 |
3.75 |
-8.74 |
-0.27 |
0 |
|
|
323104 |
126672540 |
1 |
N2O3C9H10 |
A2B3C9D10 |
-57.3 |
3.25 |
-9.58 |
-0.93 |
0 |
|
|
323105 |
126672542 |
2 |
ON2C8H11 |
AB2C8D11 |
-16.89 |
4.51 |
-8.88 |
-0.33 |
0 |
|
|
323106 |
126672544 |
1 |
OSN4F5C19H21 |
ABC4D5E19F21 |
-221.13 |
2.19 |
-8.69 |
-1.3 |
0 |
|
|
323107 |
126672546 |
1 |
O3C11H14 |
A3B11C14 |
-72.96 |
1.36 |
-8.82 |
-0.45 |
0 |
|
|
323108 |
126672552 |
1 |
OF4N5C19H23 |
AB4C5D19E23 |
-164.02 |
6.78 |
-8.66 |
-0.1 |
0 |
|
|
323109 |
126672567 |
1 |
NO4C12H15 |
AB4C12D15 |
-136.18 |
3.26 |
-9.48 |
-0.73 |
0 |
|
|
323110 |
126672618 |
1 |
OSC48H86 |
ABC48D86 |
-152.49 |
1.81 |
-5.9 |
1.42 |
0 |
|
|
323111 |
126672623 |
1 |
NOC24H25 |
ABC24D25 |
-2.29 |
4.3 |
-8.78 |
-0.49 |
0 |
|
|
323112 |
126672631 |
1 |
OC17H20 |
AB17C20 |
-32.47 |
1.05 |
-9.01 |
0.13 |
0 |
|
|
323113 |
126672638 |
1 |
ClO2F3N7C26H27 |
AB2C3D7E26F27 |
-114.37 |
10.06 |
-8.76 |
-0.95 |
0 |
|
|
323114 |
126672642 |
1 |
ClN2F3O3H14C19 |
AB2C3D3E14F19 |
-181.64 |
2.76 |
-9.27 |
-1.39 |
0 |
|
|
323115 |
126672644 |
2 |
NO2C10H10 |
AB2C10D10 |
-87.74 |
3.58 |
-7.94 |
-0.61 |
0 |
|
|
323116 |
126672651 |
1 |
O2N3F5H24C25 |
A2B3C5D24E25 |
-289.25 |
8.75 |
-8.47 |
-0.71 |
0 |
|
|
323117 |
126672675 |
1 |
IO4H15C25 |
AB4C15D25 |
-34.24 |
2.74 |
-8.75 |
-1.2 |
0 |
|
|
323118 |
126672685 |
1 |
SN2P2O3H52C73 |
AB2C2D3E52F73 |
136.66 |
9.46 |
-8.24 |
-1.14 |
0 |
|
|
323119 |
126672688 |
2 |
NH13C16 |
AB13C16 |
123.76 |
2.77 |
-8.01 |
-0.34 |
0 |
|
|
323120 |
126672697 |
1 |
NO6C39H67 |
AB6C39D67 |
-373.21 |
6.37 |
-9.12 |
0.96 |
0 |
|
|
323121 |
126672705 |
1 |
O3N4C5H8 |
A3B4C5D8 |
-42.84 |
4.16 |
-9.42 |
-0.74 |
0 |
|
|
323122 |
126672708 |
1 |
N5O5C11H15 |
A5B5C11D15 |
-134.38 |
2.13 |
-9.3 |
-0.66 |
0 |
|
|
323123 |
126672720 |
1 |
NC28H51 |
AB28C51 |
-60.44 |
1.79 |
-8.11 |
1.42 |
0 |
|
|
323124 |
126672727 |
1 |
IO5H19C28 |
AB5C19D28 |
-83.9 |
5.45 |
-8.68 |
-0.88 |
0 |
|
|
323125 |
126672730 |
1 |
SN4H36C53 |
AB4C36D53 |
312.64 |
3.4 |
-7.96 |
-1.34 |
0 |
|
|
323126 |
126672735 |
1 |
NO2C6H11 |
AB2C6D11 |
-34.88 |
3.39 |
-9.93 |
0.29 |
0 |
|
|
323127 |
126672736 |
2 |
O2H21C25 |
A2B21C25 |
-54.42 |
1.93 |
-8.36 |
-0.89 |
0 |
|
|
323128 |
126672749 |
1 |
NPS2H26C40 |
ABC2D26E40 |
137.72 |
6.16 |
-7.89 |
-1.01 |
0 |
|
|
323129 |
126672752 |
1 |
NPS2H26C40 |
ABC2D26E40 |
140.64 |
5.91 |
-7.95 |
-0.97 |
0 |
|
|
323130 |
126672778 |
1 |
O2N3H15C18 |
A2B3C15D18 |
-10.75 |
3.84 |
-8.78 |
-0.59 |
0 |
|
|
323131 |
126672802 |
1 |
N3O3H19C20 |
A3B3C19D20 |
-48.72 |
3.66 |
-8.77 |
-0.45 |
0 |
|
|
323132 |
126672810 |
1 |
OSN3H11C16 |
ABC3D11E16 |
79.91 |
2.87 |
-8.98 |
-1.22 |
0 |
|
|
323133 |
126672821 |
1 |
N5C31H31 |
A5B31C31 |
128.6 |
3.23 |
-7.79 |
-0.25 |
0 |
|
|
323134 |
126672829 |
1 |
SO3N4C18H22 |
AB3C4D18E22 |
-22.1 |
4.57 |
-8.15 |
-0.89 |
0 |
|
|
323135 |
126672837 |
1 |
ON4H14C19 |
AB4C14D19 |
97.92 |
3.7 |
-9.25 |
-1.42 |
0 |