List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
417452 |
135094681 |
1 |
S2N3O4C16H21 |
A2B3C4D16E21 |
-128.72 |
1.42 |
-9.43 |
-0.98 |
0 |
|
|
417453 |
135094682 |
1 |
O2N5C20H25 |
A2B5C20D25 |
-16.89 |
3.43 |
-8.59 |
-0.6 |
0 |
|
|
417454 |
135094683 |
1 |
ClNO5H12C14 |
ABC5D12E14 |
-165.91 |
4.96 |
-10.09 |
-0.92 |
0 |
|
|
417455 |
135094684 |
1 |
O2N3C22H23 |
A2B3C22D23 |
-25.02 |
2.9 |
-8.41 |
-0.53 |
0 |
|
|
417456 |
135094685 |
1 |
SN2O5C17H24 |
AB2C5D17E24 |
-195.44 |
6.26 |
-9.56 |
-0.54 |
0 |
|
|
417457 |
135094723 |
1 |
SO7N8C34H44 |
AB7C8D34E44 |
-190.0 |
5.24 |
-8.17 |
-0.92 |
0 |
|
|
417458 |
135094898 |
1 |
O2N3C18H23 |
A2B3C18D23 |
-61.09 |
3.55 |
-8.54 |
-0.18 |
0 |
|
|
417459 |
135094899 |
1 |
N2O3C24H26 |
A2B3C24D26 |
-74.25 |
1.74 |
-8.41 |
-0.22 |
0 |
|
|
417460 |
135094900 |
1 |
FO3N4C18H19 |
AB3C4D18E19 |
-108.93 |
2.8 |
-8.7 |
-0.72 |
0 |
|
|
417461 |
135094901 |
1 |
NO5C14H17 |
AB5C14D17 |
-207.64 |
6.93 |
-9.44 |
-0.58 |
0 |
|
|
417463 |
135094903 |
1 |
NSO3C21H21 |
ABC3D21E21 |
-81.65 |
5.61 |
-9.31 |
-0.75 |
0 |
|
|
417464 |
135095029 |
1 |
O2N4C13H24 |
A2B4C13D24 |
-65.03 |
4.42 |
-9.15 |
0.63 |
0 |
|
|
417465 |
135095121 |
2 |
ON3C10H13 |
AB3C10D13 |
-18.73 |
3.01 |
-8.89 |
-0.63 |
0 |
|
|
417466 |
135095122 |
1 |
SN2O4C17H20 |
AB2C4D17E20 |
-116.33 |
2.34 |
-8.62 |
-0.57 |
0 |
|
|
417468 |
135095124 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-0.61 |
1.08 |
-8.44 |
-0.44 |
0 |
|
|
417469 |
135095125 |
1 |
N2O4C19H26 |
A2B4C19D26 |
-90.52 |
8.91 |
-9.31 |
-0.31 |
0 |
|
|
417470 |
135095126 |
1 |
N2O3C21H32 |
A2B3C21D32 |
-127.76 |
1.83 |
-8.67 |
0.23 |
0 |
|
|
417472 |
135095128 |
1 |
N3O4C22H27 |
A3B4C22D27 |
-132.21 |
3.36 |
-9.06 |
-0.34 |
0 |
|
|
417473 |
135095129 |
1 |
O5N7C31H45 |
A5B7C31D45 |
-195.59 |
5.76 |
-8.91 |
-0.11 |
0 |
|
|
417474 |
135095243 |
1 |
FS2N6O7C34H47 |
AB2C6D7E34F47 |
-328.22 |
4.94 |
-8.59 |
-1.34 |
0 |
|
|
417475 |
135095256 |
1 |
N2S2O5C15H24 |
A2B2C5D15E24 |
-190.6 |
3.58 |
-9.74 |
-0.68 |
0 |
|
|
417476 |
135095260 |
1 |
ON5C15H21 |
AB5C15D21 |
4.46 |
3.22 |
-8.96 |
-0.11 |
0 |
|
|
417477 |
135095266 |
1 |
SN3O4C18H23 |
AB3C4D18E23 |
-133.39 |
6.36 |
-9.63 |
-1.05 |
0 |
|
|
417478 |
135095267 |
1 |
N5O6C27H39 |
A5B6C27D39 |
-247.81 |
7.97 |
-9.43 |
-0.01 |
0 |
|
|
417479 |
135095326 |
1 |
ON2C20H28 |
AB2C20D28 |
-19.39 |
4.23 |
-7.92 |
0.49 |
0 |
|
|
417480 |
135095327 |
1 |
N2O3C19H22 |
A2B3C19D22 |
-51.74 |
3.62 |
-8.75 |
-0.74 |
0 |
|
|
417481 |
135095328 |
1 |
N5C16H19 |
A5B16C19 |
110.49 |
2.11 |
-8.92 |
-0.37 |
0 |
|
|
417482 |
135095329 |
1 |
N4O4C17H20 |
A4B4C17D20 |
-9.16 |
6.04 |
-9.38 |
-0.7 |
0 |
|
|
417483 |
135095330 |
1 |
N4O5C26H40 |
A4B5C26D40 |
-240.0 |
7.64 |
-8.96 |
0.0 |
0 |
|
|
417484 |
135095331 |
1 |
NO2F3C18H24 |
AB2C3D18E24 |
-258.14 |
6.98 |
-9.02 |
-0.4 |
0 |
|
|
417485 |
135095332 |
1 |
FN3O3C16H18 |
AB3C3D16E18 |
-61.97 |
4.21 |
-8.9 |
-1.14 |
0 |
|
|
417486 |
135095370 |
1 |
SN3O4C16H21 |
AB3C4D16E21 |
-98.15 |
3.52 |
-9.07 |
-0.36 |
0 |
|
|
417487 |
135095414 |
1 |
SO6N8C41H50 |
AB6C8D41E50 |
-173.43 |
8.1 |
-8.29 |
-0.83 |
0 |
|
|
417488 |
135095436 |
1 |
N2O3C19H26 |
A2B3C19D26 |
-124.21 |
2.27 |
-8.88 |
0.26 |
0 |
|
|
417489 |
135095515 |
1 |
NSO5C14H19 |
ABC5D14E19 |
-214.75 |
5.38 |
-9.72 |
-0.74 |
0 |
|
|
417490 |
135095551 |
4 |
NC4H7 |
AB4C7 |
17.45 |
4.69 |
-8.67 |
0.95 |
0 |
|
|
417491 |
135095552 |
1 |
SN6O7C37H50 |
AB6C7D37E50 |
-299.92 |
7.75 |
-9.33 |
-0.64 |
0 |
|
|
417492 |
135095553 |
1 |
O5N9C30H35 |
A5B9C30D35 |
-44.68 |
3.96 |
-8.65 |
-1.28 |
0 |
|
|
417493 |
135095554 |
1 |
N5O5C35H47 |
A5B5C35D47 |
-198.98 |
3.62 |
-9.52 |
-0.83 |
0 |
|
|
417494 |
135095555 |
2 |
N3C9H11 |
A3B9C11 |
104.96 |
3.52 |
-8.81 |
-1.16 |
0 |
|
|
417495 |
135095556 |
1 |
N2O3C21H32 |
A2B3C21D32 |
-137.77 |
8.39 |
-8.83 |
0.08 |
0 |
|
|
417496 |
135095557 |
1 |
N7O7C33H47 |
A7B7C33D47 |
-280.15 |
4.25 |
-9.12 |
-0.14 |
0 |
|
|
417498 |
135095559 |
1 |
F3O6N7C32H40 |
A3B6C7D32E40 |
-352.38 |
13.57 |
-8.83 |
-0.98 |
0 |
|
|
417499 |
135095707 |
1 |
FOSN2C19H21 |
ABCD2E19F21 |
-19.05 |
2.98 |
-8.88 |
-0.92 |
0 |
|
|
417500 |
135095796 |
1 |
ClFON4C16H20 |
ABCD4E16F20 |
-51.39 |
3.4 |
-8.72 |
-0.61 |
0 |
|
|
417501 |
135095950 |
1 |
N2O4C17H24 |
A2B4C17D24 |
-122.21 |
5.5 |
-8.42 |
0.07 |
0 |
|
|
417502 |
135096149 |
1 |
OSN5C20H23 |
ABC5D20E23 |
23.88 |
3.55 |
-8.5 |
-0.14 |
0 |
|
|
417503 |
135096164 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-45.03 |
2.57 |
-9.32 |
0.37 |
0 |
|
|
417504 |
135096213 |
2 |
ON2C11H13 |
AB2C11D13 |
-33.79 |
4.43 |
-8.96 |
-0.73 |
0 |
|
|
417505 |
135096261 |
1 |
F3N4O4H15C16 |
A3B4C4D15E16 |
-258.49 |
7.97 |
-9.92 |
-0.7 |
0 |
|
|
417506 |
135096357 |
1 |
O2N3C20H25 |
A2B3C20D25 |
15.41 |
3.77 |
-8.85 |
-0.66 |
0 |
|
|
417507 |
135096444 |
1 |
O2N5C21H25 |
A2B5C21D25 |
-17.42 |
3.62 |
-8.14 |
-0.08 |
0 |
|
|
417508 |
135096495 |
1 |
FN4O5C36H43 |
AB4C5D36E43 |
-224.94 |
9.69 |
-8.86 |
-0.12 |
0 |
|
|
417511 |
135096760 |
1 |
SO3N5C20H25 |
AB3C5D20E25 |
-38.39 |
4.28 |
-9.43 |
-0.77 |
0 |
|
|
417512 |
135096975 |
1 |
SO2N3C16H21 |
AB2C3D16E21 |
-53.48 |
3.86 |
-9.0 |
-0.33 |
0 |
|
|
417513 |
135096995 |
1 |
N5O7C30H47 |
A5B7C30D47 |
-322.82 |
4.96 |
-8.95 |
0.02 |
0 |
|
|
417514 |
135097538 |
1 |
O2N3C23H29 |
A2B3C23D29 |
-35.1 |
5.85 |
-8.8 |
-0.31 |
0 |
|
|
417515 |
135098003 |
1 |
ON6C20H30 |
AB6C20D30 |
15.02 |
0.81 |
-8.51 |
0.05 |
0 |
|
|
417516 |
135098058 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-141.66 |
6.95 |
-9.4 |
-0.43 |
0 |
|
|
417517 |
135098078 |
1 |
O3N4C13H22 |
A3B4C13D22 |
-103.48 |
4.54 |
-9.79 |
0.03 |
0 |
|
|
417518 |
135098089 |
1 |
ClON3C19H26 |
ABC3D19E26 |
-26.67 |
2.47 |
-8.52 |
-0.2 |
0 |
|
|
417519 |
135098401 |
2 |
N2O2C10H13 |
A2B2C10D13 |
-123.32 |
9.62 |
-8.45 |
0.07 |
0 |
|
|
417520 |
135098475 |
1 |
ClN3C14H22 |
AB3C14D22 |
12.93 |
2.44 |
-8.48 |
-0.16 |
0 |
|
|
417522 |
135098493 |
1 |
OSN5C21H29 |
ABC5D21E29 |
-18.58 |
9.7 |
-8.64 |
-0.73 |
0 |
|
|
417523 |
135098510 |
1 |
O7N8C37H48 |
A7B8C37D48 |
-251.53 |
7.85 |
-9.19 |
-0.85 |
0 |
|
|
417524 |
135098518 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-93.94 |
2.05 |
-9.04 |
0.08 |
0 |
|
|
417525 |
135098564 |
1 |
SO4N6C15H20 |
AB4C6D15E20 |
-61.83 |
5.23 |
-9.63 |
-0.66 |
0 |
|
|
417526 |
135098642 |
1 |
FO2N4C16H19 |
AB2C4D16E19 |
-64.7 |
5.92 |
-8.68 |
-0.53 |
0 |
|
|
417527 |
135098814 |
1 |
FO2N3C18H22 |
AB2C3D18E22 |
-31.87 |
3.69 |
-8.7 |
-0.54 |
0 |
|
|
417528 |
135099042 |
1 |
O3N4H20C23 |
A3B4C20D23 |
-29.45 |
5.89 |
-9.38 |
-1.33 |
0 |
|
|
417529 |
135099182 |
1 |
NO3F4C17H21 |
AB3C4D17E21 |
-337.94 |
5.89 |
-9.31 |
-0.8 |
0 |
|
|
417530 |
135099189 |
1 |
O3N7C30H39 |
A3B7C30D39 |
-59.63 |
2.85 |
-8.95 |
-0.05 |
0 |
|
|
417531 |
135099380 |
2 |
ON3C9H12 |
AB3C9D12 |
-7.24 |
3.28 |
-8.86 |
-0.27 |
0 |
|
|
417532 |
135099381 |
1 |
FO2N3C16H20 |
AB2C3D16E20 |
-104.81 |
4.07 |
-9.3 |
-0.13 |
0 |
|
|
417534 |
135099575 |
1 |
ON3C19H25 |
AB3C19D25 |
-7.32 |
4.65 |
-8.8 |
-0.81 |
0 |
|
|
417535 |
135099576 |
1 |
N2O3C19H26 |
A2B3C19D26 |
-112.68 |
2.98 |
-8.87 |
-0.14 |
0 |
|
|
417536 |
135099579 |
3 |
NOC7H9 |
ABC7D9 |
43.92 |
4.63 |
-8.7 |
0.08 |
0 |
|
|
417537 |
135099608 |
1 |
SO2N3C17H21 |
AB2C3D17E21 |
-43.31 |
3.49 |
-9.6 |
-0.95 |
0 |
|
|
417538 |
135099936 |
1 |
N3O4C21H27 |
A3B4C21D27 |
-100.11 |
7.81 |
-8.9 |
-0.81 |
0 |
|
|
417539 |
135099959 |
1 |
FON4C17H23 |
ABC4D17E23 |
-44.06 |
2.73 |
-9.07 |
-0.03 |
0 |
|
|
417540 |
135100176 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-8.68 |
5.62 |
-9.34 |
-1.12 |
0 |
|
|
417541 |
135100425 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-56.63 |
2.6 |
-8.04 |
-0.44 |
0 |
|
|
417542 |
135100735 |
2 |
NO2C10H12 |
AB2C10D12 |
-106.53 |
2.85 |
-9.74 |
-0.51 |
0 |
|
|
417543 |
135100835 |
1 |
N3O4C18H23 |
A3B4C18D23 |
-101.92 |
3.14 |
-9.64 |
-0.29 |
0 |
|
|
417544 |
135100988 |
1 |
ON3C14H23 |
AB3C14D23 |
13.84 |
2.5 |
-8.67 |
0.24 |
0 |
|
|
417545 |
135101245 |
1 |
N3O4C21H31 |
A3B4C21D31 |
-157.49 |
7.26 |
-8.97 |
0.41 |
0 |
|
|
417546 |
135101594 |
1 |
SN2O2C14H20 |
AB2C2D14E20 |
-51.33 |
5.22 |
-8.93 |
-0.2 |
0 |
|
|
417548 |
135101815 |
1 |
N2O3C20H30 |
A2B3C20D30 |
-125.4 |
6.1 |
-8.9 |
0.21 |
0 |
|
|
417549 |
135101913 |
1 |
O2N5C15H23 |
A2B5C15D23 |
-47.83 |
7.11 |
-8.84 |
0.2 |
0 |
|
|
417550 |
135102024 |
2 |
ON2C12H14 |
AB2C12D14 |
-28.25 |
6.65 |
-9.15 |
-0.55 |
0 |
|
|
417551 |
135102025 |
1 |
O4N6C27H32 |
A4B6C27D32 |
-34.0 |
7.55 |
-8.59 |
-0.6 |
0 |
|
|
417552 |
135102026 |
1 |
SN4O4C16H26 |
AB4C4D16E26 |
-136.65 |
3.33 |
-9.21 |
-0.14 |
0 |
|
|
417553 |
135102028 |
1 |
O3N4C16H24 |
A3B4C16D24 |
-98.68 |
5.99 |
-9.64 |
-0.58 |
0 |
|
|
417554 |
135102029 |
2 |
NO2C9H10 |
AB2C9D10 |
-100.07 |
7.72 |
-9.13 |
-0.94 |
0 |
|
|
417555 |
135102031 |
1 |
N5C18H23 |
A5B18C23 |
40.33 |
3.21 |
-8.57 |
0.02 |
0 |
|
|
417556 |
135102033 |
2 |
ON2C9H13 |
AB2C9D13 |
-43.85 |
2.88 |
-8.76 |
0.5 |
0 |
|
|
417557 |
135102034 |
2 |
N3C9H13 |
A3B9C13 |
69.18 |
3.96 |
-8.63 |
-0.06 |
0 |
|
|
417558 |
135102038 |
1 |
N6O7C39H48 |
A6B7C39D48 |
-253.06 |
2.61 |
-8.86 |
-0.48 |
0 |
|
|
417559 |
135102042 |
1 |
ON4C21H30 |
AB4C21D30 |
7.92 |
1.94 |
-8.7 |
-0.43 |
0 |
|
|
417560 |
135102044 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-32.4 |
7.42 |
-8.28 |
-0.82 |
0 |