List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
311086 |
126589260 |
1 |
NF3O3C19H20 |
AB3C3D19E20 |
-263.58 |
3.92 |
-9.15 |
-0.53 |
0 |
|
|
311087 |
126589261 |
1 |
NF2O4C20H23 |
AB2C4D20E23 |
-246.33 |
4.54 |
-9.1 |
-0.47 |
0 |
|
|
311088 |
126589272 |
1 |
FNO3C20H24 |
ABC3D20E24 |
-166.0 |
3.57 |
-8.72 |
-0.19 |
0 |
|
|
311089 |
126589309 |
1 |
BrFNO4C18H19 |
ABCD4E18F19 |
-143.41 |
5.96 |
-8.48 |
-0.73 |
0 |
|
|
311090 |
126589313 |
1 |
FNO5C20H24 |
ABC5D20E24 |
-192.03 |
1.9 |
-8.44 |
-0.26 |
0 |
|
|
311091 |
126589333 |
1 |
FN2O2C18H21 |
AB2C2D18E21 |
-96.8 |
5.48 |
-8.32 |
-0.27 |
0 |
|
|
311092 |
126589345 |
1 |
NO2C17H33 |
AB2C17D33 |
-145.83 |
2.93 |
-9.34 |
0.89 |
0 |
|
|
311093 |
126589360 |
1 |
BrN2O2C20H25 |
AB2C2D20E25 |
-53.72 |
5.08 |
-8.59 |
-0.36 |
0 |
|
|
311094 |
126589361 |
1 |
NSO3C21H27 |
ABC3D21E27 |
-65.51 |
3.53 |
-8.62 |
-0.41 |
0 |
|
|
311095 |
126589362 |
1 |
FNSO3C19H22 |
ABCD3E19F22 |
-99.32 |
2.98 |
-8.2 |
-0.97 |
0 |
|
|
311096 |
126589373 |
1 |
N2O2C23H30 |
A2B2C23D30 |
-50.31 |
5.22 |
-8.42 |
-0.21 |
0 |
|
|
311097 |
126589392 |
1 |
NF2O2C21H25 |
AB2C2D21E25 |
-173.66 |
5.09 |
-8.54 |
-0.37 |
0 |
|
|
311098 |
126589420 |
1 |
N2O6C13H18 |
A2B6C13D18 |
-213.9 |
3.67 |
-10.03 |
-0.63 |
0 |
|
|
311099 |
126589424 |
1 |
SN5O5C18H25 |
AB5C5D18E25 |
-210.44 |
4.57 |
-9.3 |
0.18 |
0 |
|
|
311100 |
126589427 |
1 |
BrNOSC19H22 |
ABCDE19F22 |
-3.88 |
5.33 |
-8.68 |
-0.65 |
0 |
|
|
311101 |
126589428 |
1 |
FN2O3C23H23 |
AB2C3D23E23 |
-106.91 |
5.46 |
-8.54 |
-1.16 |
0 |
|
|
311102 |
126589429 |
1 |
NOC13H23 |
ABC13D23 |
-72.28 |
2.36 |
-8.94 |
0.59 |
0 |
|
|
311103 |
126589430 |
1 |
NO3C9H11 |
AB3C9D11 |
-107.26 |
4.08 |
-8.26 |
-0.37 |
0 |
|
|
311104 |
126589431 |
1 |
NOSC22H29 |
ABCD22E29 |
-23.61 |
3.86 |
-8.36 |
-0.22 |
0 |
|
|
311105 |
126589432 |
1 |
FNOSC19H22 |
ABCDE19F22 |
-54.18 |
4.59 |
-8.53 |
-0.54 |
0 |
|
|
311106 |
126589433 |
1 |
INOSC19H22 |
ABCDE19F22 |
9.68 |
4.35 |
-8.48 |
-1.01 |
0 |
|
|
311107 |
126589438 |
1 |
NO3C21H27 |
AB3C21D27 |
-84.8 |
3.05 |
-8.28 |
-0.07 |
0 |
|
|
311108 |
126589440 |
1 |
NSO2C20H25 |
ABC2D20E25 |
-48.26 |
3.62 |
-8.44 |
-0.54 |
0 |
|
|
311109 |
126589441 |
1 |
NSO2C21H27 |
ABC2D21E27 |
-54.63 |
4.5 |
-8.52 |
-0.4 |
0 |
|
|
311110 |
126589442 |
1 |
NO3C22H29 |
AB3C22D29 |
-89.58 |
3.2 |
-8.28 |
-0.07 |
0 |
|
|
311111 |
126589443 |
1 |
NO4C21H27 |
AB4C21D27 |
-119.85 |
1.87 |
-8.58 |
-0.08 |
0 |
|
|
311112 |
126589444 |
1 |
FNO3C19H22 |
ABC3D19E22 |
-118.11 |
3.38 |
-8.62 |
-0.44 |
0 |
|
|
311113 |
126589445 |
1 |
NF3O3C20H22 |
AB3C3D20E22 |
-232.84 |
5.08 |
-8.69 |
-0.87 |
0 |
|
|
311114 |
126589446 |
1 |
N2O4C11H16 |
A2B4C11D16 |
-162.33 |
3.23 |
-10.11 |
-1.64 |
0 |
|
|
311115 |
126589447 |
1 |
FN7O8H36C37 |
AB7C8D36E37 |
-292.57 |
14.1 |
-9.29 |
-1.62 |
0 |
|
|
311116 |
126589448 |
1 |
FIN2O4C22H22 |
ABC2D4E22F22 |
-172.4 |
5.11 |
-9.47 |
-1.65 |
0 |
|
|
311117 |
126589457 |
1 |
NOC16H35 |
ABC16D35 |
-119.67 |
3.67 |
-8.82 |
2.97 |
0 |
|
|
311118 |
126589462 |
1 |
FN2O4H19C22 |
AB2C4D19E22 |
-147.82 |
7.18 |
-8.43 |
-1.57 |
0 |
|
|
311119 |
126589474 |
1 |
N6O7C22H32 |
A6B7C22D32 |
-310.43 |
1.47 |
-9.64 |
-0.03 |
0 |
|
|
311120 |
126589503 |
1 |
ON2C9H14 |
AB2C9D14 |
-8.31 |
3.43 |
-9.02 |
0.25 |
0 |
|
|
311121 |
126589504 |
1 |
NO4C8H9 |
AB4C8D9 |
-151.75 |
2.43 |
-9.43 |
-0.91 |
0 |
|
|
311122 |
126589505 |
1 |
N3O3C6H13 |
A3B3C6D13 |
-117.46 |
6.16 |
-9.93 |
0.37 |
0 |
|
|
311123 |
126589506 |
1 |
N2O3C16H30 |
A2B3C16D30 |
-175.07 |
2.57 |
-9.36 |
0.94 |
0 |
|
|
311124 |
126589507 |
1 |
O3N4C18H30 |
A3B4C18D30 |
-137.68 |
4.02 |
-9.19 |
0.14 |
0 |
|
|
311125 |
126589508 |
1 |
FOCl2N5C18H24 |
ABC2D5E18F24 |
-37.15 |
4.01 |
-8.12 |
-1.07 |
0 |
|
|
311126 |
126589509 |
1 |
FN2O4H19C23 |
AB2C4D19E23 |
-55.01 |
11.85 |
-9.43 |
-1.71 |
0 |
|
|
311127 |
126589510 |
2 |
NOC6H10 |
ABC6D10 |
-78.04 |
2.25 |
-8.89 |
-1.53 |
0 |
|
|
311128 |
126589511 |
2 |
N2O2C8H13 |
A2B2C8D13 |
-161.86 |
5.84 |
-9.2 |
-0.88 |
0 |
|
|
311129 |
126589512 |
1 |
NOC11H21 |
ABC11D21 |
-64.01 |
3.86 |
-8.93 |
0.61 |
0 |
|
|
311130 |
126589513 |
1 |
N8O9C24H42 |
A8B9C24D42 |
-396.61 |
6.1 |
-9.57 |
-0.61 |
0 |
|
|
311131 |
126589525 |
1 |
NOC10H17 |
ABC10D17 |
-28.16 |
2.51 |
-8.73 |
0.23 |
0 |
|
|
311132 |
126589549 |
1 |
N5O8C29H35 |
A5B8C29D35 |
-323.28 |
8.29 |
-8.84 |
-0.39 |
0 |
|
|
311133 |
126589551 |
1 |
N6O7C21H32 |
A6B7C21D32 |
-308.57 |
6.09 |
-9.82 |
-0.24 |
0 |
|
|
311134 |
126589575 |
1 |
BrN2O3C20H35 |
AB2C3D20E35 |
-133.96 |
1.95 |
-8.26 |
-0.04 |
0 |
|
|
311135 |
126589577 |
1 |
FNC11H12 |
ABC11D12 |
-7.74 |
5.37 |
-8.84 |
-0.9 |
0 |
|
|
311136 |
126589578 |
1 |
FNO3C23H30 |
ABC3D23E30 |
-164.06 |
3.67 |
-8.47 |
-0.46 |
0 |
|
|
311137 |
126589579 |
1 |
BrN7O7C24H34 |
AB7C7D24E34 |
-315.65 |
10.5 |
-9.42 |
-1.13 |
0 |
|
|
311138 |
126589583 |
1 |
FN2O4C25H29 |
AB2C4D25E29 |
-127.48 |
4.63 |
-9.14 |
-1.13 |
0 |
|
|
311139 |
126589592 |
1 |
NO2C14H23 |
AB2C14D23 |
-89.27 |
2.98 |
-8.98 |
0.31 |
0 |
|
|
311140 |
126589603 |
1 |
FN4O5C27H27 |
AB4C5D27E27 |
-205.39 |
12.97 |
-9.24 |
-1.72 |
0 |
|
|
311141 |
126589605 |
1 |
FN8O9C34H37 |
AB8C9D34E37 |
-369.86 |
9.82 |
-9.23 |
-1.62 |
0 |
|
|
311142 |
126589609 |
1 |
FN9O10C61H66 |
AB9C10D61E66 |
-31.64 |
3.99 |
-7.33 |
-2.18 |
0 |
|
|
311143 |
126589612 |
1 |
FIN2O4C22H24 |
ABC2D4E22F24 |
-164.53 |
8.38 |
-9.48 |
-1.27 |
0 |
|
|
311144 |
126589623 |
1 |
O4N5C15H21 |
A4B5C15D21 |
-159.25 |
1.86 |
-9.61 |
0.07 |
0 |
|
|
311145 |
126589624 |
1 |
FN10O16C63H83 |
AB10C16D63E83 |
-669.78 |
13.21 |
-8.38 |
-1.55 |
0 |
|
|
311146 |
126589625 |
1 |
N2O3C23H26 |
A2B3C23D26 |
-109.26 |
8.0 |
-8.98 |
-0.73 |
0 |
|
|
311147 |
126589630 |
1 |
N5O6C18H25 |
A5B6C18D25 |
-258.42 |
4.24 |
-9.81 |
-0.1 |
0 |
|
|
311148 |
126589631 |
1 |
FN2O4C25H27 |
AB2C4D25E27 |
-168.46 |
7.41 |
-9.12 |
-1.12 |
0 |
|
|
311149 |
126589632 |
1 |
N7O10C20H27 |
A7B10C20D27 |
-337.22 |
4.34 |
-9.5 |
-0.75 |
0 |
|
|
311150 |
126589633 |
1 |
FN2O4H23C24 |
AB2C4D23E24 |
-114.83 |
9.59 |
-8.19 |
-1.51 |
0 |
|
|
311151 |
126589634 |
1 |
N7O10C30H39 |
A7B10C30D39 |
-417.66 |
6.98 |
-9.66 |
-1.87 |
0 |
|
|
311152 |
126589646 |
1 |
N2O4C23H24 |
A2B4C23D24 |
-96.03 |
8.21 |
-9.08 |
-0.99 |
0 |
|
|
311153 |
126589647 |
1 |
FO3N4C24H29 |
AB3C4D24E29 |
-19.67 |
2.05 |
-8.87 |
-0.99 |
0 |
|
|
311154 |
126589649 |
1 |
O3S3C28H30 |
A3B3C28D30 |
-45.35 |
2.83 |
-8.8 |
-0.66 |
0 |
|
|
311155 |
126589650 |
1 |
NS2O3C32H37 |
AB2C3D32E37 |
-46.72 |
4.13 |
-8.25 |
-0.54 |
0 |
|
|
311156 |
126589652 |
1 |
ClS2F4O4H25C27 |
AB2C4D4E25F27 |
-302.55 |
5.93 |
-9.07 |
-1.0 |
0 |
|
|
311157 |
126589653 |
1 |
NS2O4C30H33 |
AB2C4D30E33 |
-80.77 |
3.37 |
-9.04 |
-0.84 |
0 |
|
|
311158 |
126589654 |
1 |
ON3C9H17 |
AB3C9D17 |
-31.59 |
1.3 |
-8.93 |
0.56 |
0 |
|
|
311159 |
126589656 |
1 |
FNS2O4C30H32 |
ABC2D4E30F32 |
-121.59 |
4.33 |
-9.09 |
-1.06 |
0 |
|
|
311160 |
126589658 |
1 |
OC14H26 |
AB14C26 |
-94.18 |
2.88 |
-9.3 |
0.87 |
0 |