List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
379562 |
134444914 |
1 |
O2F3N8C26H27 |
A2B3C8D26E27 |
-107.78 |
8.79 |
-8.19 |
-1.71 |
0 |
|
|
379563 |
134445372 |
1 |
NF3O5C28H34 |
AB3C5D28E34 |
-340.13 |
4.32 |
-9.55 |
-0.72 |
0 |
|
|
379564 |
134445563 |
2 |
SC7H10 |
AB7C10 |
-1.36 |
1.28 |
-8.16 |
-0.37 |
0 |
|
|
379565 |
134445580 |
1 |
NSO3C8H9 |
ABC3D8E9 |
-75.74 |
6.96 |
-10.27 |
-0.73 |
0 |
|
|
379566 |
134445582 |
1 |
N3H45C58 |
A3B45C58 |
262.21 |
0.59 |
-8.93 |
-1.09 |
0 |
|
|
379567 |
134445584 |
1 |
ON2C25H32 |
AB2C25D32 |
22.88 |
1.08 |
-7.55 |
0.41 |
0 |
|
|
379568 |
134445687 |
1 |
FO2N4H19C22 |
AB2C4D19E22 |
-39.34 |
4.44 |
-8.38 |
-0.52 |
0 |
|
|
379569 |
134445768 |
1 |
N5H39C59 |
A5B39C59 |
388.73 |
5.79 |
-8.41 |
-1.32 |
0 |
|
|
379570 |
134445907 |
1 |
ClSO3N5H30C34 |
ABC3D5E30F34 |
-8.75 |
7.29 |
-8.63 |
-0.71 |
0 |
|
|
379571 |
134445981 |
1 |
ClFO2N8C23H30 |
ABC2D8E23F30 |
-47.29 |
8.26 |
-8.94 |
-0.31 |
0 |
|
|
379572 |
134446211 |
1 |
N2H16C19 |
A2B16C19 |
72.28 |
4.03 |
-7.76 |
-0.19 |
0 |
|
|
379573 |
134446337 |
2 |
NC4H8 |
AB4C8 |
19.93 |
2.89 |
-8.28 |
0.93 |
0 |
|
|
379574 |
134446480 |
1 |
FO2N6C27H29 |
AB2C6D27E29 |
-15.71 |
3.82 |
-8.59 |
-1.05 |
0 |
|
|
379575 |
134446491 |
1 |
OSN6C22H22 |
ABC6D22E22 |
82.37 |
6.35 |
-8.8 |
-1.35 |
0 |
|
|
379576 |
134446617 |
1 |
ON6C22H28 |
AB6C22D28 |
45.44 |
10.24 |
-8.33 |
-0.89 |
0 |
|
|
379577 |
134447066 |
1 |
SO2N4C20H28 |
AB2C4D20E28 |
-21.18 |
13.69 |
-9.33 |
-0.74 |
0 |
|
|
379578 |
134447543 |
1 |
SF2O2C16H20 |
AB2C2D16E20 |
-170.9 |
3.76 |
-8.57 |
-0.3 |
0 |
|
|
379579 |
134447596 |
1 |
ClO2N5C16H20 |
AB2C5D16E20 |
-3.52 |
3.09 |
-8.07 |
-0.98 |
0 |
|
|
379580 |
134447598 |
1 |
N5H67C104 |
A5B67C104 |
505.23 |
4.89 |
-8.16 |
-1.43 |
0 |
|
|
379581 |
134447601 |
1 |
NH29C37 |
AB29C37 |
133.92 |
1.82 |
-8.46 |
-0.05 |
0 |
|
|
379582 |
134447663 |
1 |
O2N4C13H18 |
A2B4C13D18 |
-26.86 |
5.69 |
-9.34 |
-0.61 |
0 |
|
|
379583 |
134447692 |
1 |
NC29H39 |
AB29C39 |
75.44 |
2.45 |
-8.62 |
0.47 |
0 |
|
|
379584 |
134447725 |
1 |
OSN2H22C39 |
ABC2D22E39 |
156.14 |
4.02 |
-8.57 |
-1.08 |
0 |
|
|
379585 |
134447744 |
1 |
FN2O3C21H21 |
AB2C3D21E21 |
-94.92 |
10.91 |
-9.1 |
-1.73 |
0 |
|
|
379586 |
134447783 |
1 |
N2H32C33 |
A2B32C33 |
148.68 |
1.83 |
-7.9 |
-0.01 |
0 |
|
|
379587 |
134448056 |
1 |
OSN4C27H30 |
ABC4D27E30 |
39.66 |
6.84 |
-8.59 |
-0.45 |
0 |
|
|
379588 |
134448064 |
1 |
NSO2C13H13 |
ABC2D13E13 |
-31.86 |
0.4 |
-9.57 |
-0.69 |
0 |
|
|
379589 |
134448253 |
1 |
F2O3C24H28 |
A2B3C24D28 |
-203.86 |
6.41 |
-9.04 |
-0.51 |
0 |
|
|
379590 |
134448258 |
1 |
NO2H29C35 |
AB2C29D35 |
46.71 |
1.04 |
-8.82 |
-0.62 |
0 |
|
|
379591 |
134448259 |
1 |
NO2H25C32 |
AB2C25D32 |
32.31 |
2.21 |
-8.48 |
-0.59 |
0 |
|
|
379592 |
134448298 |
1 |
INO2C6H12 |
ABC2D6E12 |
-92.58 |
4.52 |
-9.22 |
-1.96 |
0 |
|
|
379593 |
134448299 |
1 |
INOC7H14 |
ABCD7E14 |
-53.42 |
2.08 |
-7.92 |
-0.97 |
0 |
|
|
379594 |
134448472 |
1 |
FIO2S2N3H11C15 |
ABC2D2E3F11G15 |
79.56 |
4.49 |
-8.71 |
-2.59 |
0 |
|
|
379595 |
134448477 |
1 |
FIOS2N4C17H18 |
ABCD2E4F17G18 |
6.79 |
5.32 |
-8.41 |
-2.2 |
0 |
|
|
379596 |
134448661 |
1 |
FOPN3C13H19 |
ABCD3E13F19 |
11.58 |
2.15 |
-8.31 |
-0.4 |
0 |
|
|
379597 |
134448665 |
1 |
FON3C14H18 |
ABC3D14E18 |
-24.02 |
4.16 |
-8.63 |
0.28 |
0 |
|
|
379598 |
134448814 |
1 |
FOPN3C13H17 |
ABCD3E13F17 |
4.85 |
1.94 |
-8.27 |
-0.11 |
0 |
|
|
379599 |
134448965 |
1 |
OF2N3C13H19 |
AB2C3D13E19 |
-79.0 |
2.15 |
-8.31 |
-0.05 |
0 |
|
|
379600 |
134448967 |
1 |
BrF2O2N3H16C17 |
AB2C2D3E16F17 |
-83.81 |
4.73 |
-9.26 |
-1.41 |
0 |
|
|
379601 |
134449322 |
1 |
BrO2N4C23H29 |
AB2C4D23E29 |
-9.25 |
7.74 |
-8.25 |
-0.76 |
0 |
|
|
379603 |
134449580 |
1 |
F2O4N6H24C29 |
A2B4C6D24E29 |
-102.72 |
6.82 |
-8.72 |
-0.95 |
0 |
|
|
379604 |
134449582 |
1 |
FON2C13H17 |
ABC2D13E17 |
-31.58 |
2.75 |
-8.17 |
0.08 |
0 |
|
|
379605 |
134449640 |
1 |
SO2C8H12 |
AB2C8D12 |
-60.39 |
2.99 |
-8.7 |
-0.01 |
0 |
|
|
379606 |
134449731 |
2 |
NH25C33 |
AB25C33 |
300.96 |
0.99 |
-8.14 |
-0.25 |
0 |
|
|
379607 |
134449737 |
2 |
NO2C20H31 |
AB2C20D31 |
-187.6 |
1.32 |
-9.28 |
-1.57 |
0 |
|
|
379608 |
134449754 |
1 |
N2H42C57 |
A2B42C57 |
296.98 |
4.81 |
-7.74 |
-1.16 |
0 |
|
|
379609 |
134449764 |
1 |
N3C10H13 |
A3B10C13 |
49.68 |
2.17 |
-8.85 |
-0.38 |
0 |
|
|
379610 |
134449807 |
1 |
ClOF2N4H15C18 |
ABC2D4E15F18 |
-69.12 |
4.82 |
-8.75 |
-1.43 |
0 |
|
|
379611 |
134450161 |
1 |
N5H17C18 |
A5B17C18 |
123.18 |
3.16 |
-8.67 |
-0.82 |
0 |
|
|
379612 |
134450565 |
1 |
FN2O3C21H25 |
AB2C3D21E25 |
-133.65 |
0.96 |
-8.49 |
-0.71 |
0 |
|
|
379613 |
134450574 |
1 |
FN2O3C21H23 |
AB2C3D21E23 |
-115.85 |
4.84 |
-9.01 |
-0.52 |
0 |
|
|
379614 |
134450799 |
1 |
SN2O5C22H22 |
AB2C5D22E22 |
-113.22 |
5.76 |
-8.63 |
-0.71 |
0 |
|
|
379615 |
134450800 |
1 |
SN3O6C21H21 |
AB3C6D21E21 |
-138.08 |
12.46 |
-9.94 |
-1.11 |
0 |
|
|
379616 |
134451090 |
1 |
NH41C62 |
AB41C62 |
251.94 |
2.09 |
-8.65 |
-0.66 |
0 |
|
|
379617 |
134451553 |
1 |
Cl2O3N6H22C23 |
A2B3C6D22E23 |
-37.34 |
6.9 |
-8.91 |
-0.89 |
0 |
|
|
379618 |
134451579 |
3 |
ON2C8H10 |
AB2C8D10 |
-41.97 |
4.31 |
-8.73 |
-0.54 |
0 |
|
|
379619 |
134451670 |
2 |
OC12H20 |
AB12C20 |
-160.69 |
3.49 |
-9.2 |
1.42 |
0 |
|
|
379620 |
134451687 |
1 |
SO3C28H40 |
AB3C28D40 |
-150.96 |
6.54 |
-9.29 |
-0.53 |
0 |
|
|
379625 |
134452002 |
2 |
OC10H15 |
AB10C15 |
-129.3 |
1.89 |
-9.36 |
0.72 |
0 |
|
|
379626 |
134452003 |
1 |
O3C26H42 |
A3B26C42 |
-176.55 |
1.33 |
-9.21 |
0.84 |
0 |
|
|
379627 |
134452014 |
1 |
SO5C34H50 |
AB5C34D50 |
-255.61 |
7.64 |
-9.33 |
-0.8 |
0 |
|
|
379629 |
134452147 |
1 |
SO4F5C36H51 |
AB4C5D36E51 |
-507.22 |
8.94 |
-10.55 |
-0.89 |
0 |
|
|
379630 |
134452358 |
1 |
F3N4H9C13 |
A3B4C9D13 |
-72.87 |
6.94 |
-9.28 |
-1.54 |
0 |
|
|
379631 |
134452361 |
1 |
OF3N4C15H19 |
AB3C4D15E19 |
-184.18 |
5.57 |
-9.19 |
-0.78 |
0 |
|
|
379632 |
134452362 |
1 |
O2F3N3C16H20 |
A2B3C3D16E20 |
-241.31 |
6.3 |
-9.2 |
-0.8 |
0 |
|
|
379633 |
134452526 |
1 |
F5N5H10C16 |
A5B5C10D16 |
-130.42 |
5.48 |
-9.4 |
-1.6 |
0 |
|
|
379634 |
134452547 |
1 |
ClN5H14C17 |
AB5C14D17 |
133.33 |
3.43 |
-9.18 |
-0.87 |
0 |
|
|
379635 |
134452581 |
1 |
ClF2N5H12C16 |
AB2C5D12E16 |
9.99 |
5.8 |
-9.28 |
-0.98 |
0 |
|
|
379636 |
134452707 |
2 |
O2H17C24 |
A2B17C24 |
9.2 |
4.69 |
-8.58 |
-0.74 |
0 |
|
|
379637 |
134452708 |
2 |
O4H25C31 |
A4B25C31 |
-165.48 |
8.46 |
-8.64 |
-0.76 |
0 |
|
|
379638 |
134452853 |
1 |
NO6C12H23 |
AB6C12D23 |
-291.86 |
4.31 |
-9.78 |
0.5 |
0 |
|
|
379639 |
134453094 |
1 |
NO4C12H23 |
AB4C12D23 |
-217.64 |
5.27 |
-9.65 |
0.2 |
0 |
|
|
379640 |
134453206 |
1 |
N2Cl3O5H17C19 |
A2B3C5D17E19 |
-133.35 |
5.73 |
-9.01 |
-1.45 |
0 |
|
|
379641 |
134453226 |
1 |
OCl2N5H11C19 |
AB2C5D11E19 |
96.14 |
6.7 |
-9.22 |
-2.13 |
0 |
|
|
379642 |
134453344 |
1 |
N2O7H46C48 |
A2B7C46D48 |
-138.58 |
9.4 |
-8.04 |
-1.11 |
0 |
|
|
379643 |
134453346 |
1 |
SN3O7C39H41 |
AB3C7D39E41 |
-131.39 |
4.32 |
-8.61 |
-0.75 |
0 |
|
|
379644 |
134453353 |
1 |
SN3O9H31C40 |
AB3C9D31E40 |
-140.24 |
7.87 |
-8.7 |
-1.18 |
0 |
|
|
379645 |
134453394 |
2 |
NO7H23C26 |
AB7C23D26 |
-358.62 |
1.55 |
-8.6 |
-0.66 |
0 |
|
|
379646 |
134453690 |
1 |
NH43C62 |
AB43C62 |
254.19 |
0.9 |
-8.03 |
-0.58 |
0 |
|
|
379647 |
134453747 |
1 |
NH35C50 |
AB35C50 |
205.37 |
0.25 |
-8.01 |
-0.59 |
0 |
|
|
379648 |
134453822 |
1 |
NO3C15H27 |
AB3C15D27 |
-186.51 |
3.03 |
-9.65 |
0.3 |
0 |
|
|
379649 |
134453922 |
1 |
PSN3H34C54 |
ABC3D34E54 |
217.34 |
6.7 |
-8.65 |
-1.3 |
0 |
|
|
379650 |
134453993 |
1 |
OPN3H38C62 |
ABC3D38E62 |
223.95 |
2.96 |
-8.58 |
-1.4 |
0 |
|
|
379651 |
134454111 |
1 |
F2O3C22H24 |
A2B3C22D24 |
-180.34 |
0.86 |
-8.72 |
-0.72 |
0 |
|
|
379652 |
134454373 |
1 |
BrFSO4N7C14H17 |
ABCD4E7F14G17 |
-20.76 |
3.77 |
-8.81 |
-1.91 |
0 |
|
|
379653 |
134454523 |
1 |
N2O3C6H14 |
A2B3C6D14 |
-141.35 |
4.3 |
-9.86 |
0.72 |
0 |
|
|
379654 |
134454586 |
1 |
F2N2O2C21H24 |
A2B2C2D21E24 |
-128.96 |
3.17 |
-8.84 |
-0.46 |
0 |
|
|
379655 |
134454587 |
1 |
FN2O2C21H25 |
AB2C2D21E25 |
-87.8 |
3.97 |
-8.73 |
-0.59 |
0 |
|
|
379656 |
134454601 |
1 |
FN2O2C21H25 |
AB2C2D21E25 |
-91.03 |
3.26 |
-8.89 |
-0.42 |
0 |
|
|
379657 |
134454745 |
1 |
O5N8H24C28 |
A5B8C24D28 |
-44.3 |
7.6 |
-8.73 |
-1.65 |
0 |
|
|
379658 |
134454861 |
2 |
NH16C23 |
AB16C23 |
180.39 |
2.82 |
-7.94 |
-0.57 |
0 |
|
|
379659 |
134455173 |
2 |
N2O6H29C40 |
A2B6C29D40 |
-72.86 |
9.52 |
-9.35 |
-1.14 |
0 |
|
|
379661 |
134455263 |
1 |
SC36H52 |
AB36C52 |
36.25 |
2.19 |
-6.74 |
0.12 |
0 |
|
|
379662 |
134455286 |
1 |
BrPN3O8C11H17 |
ABC3D8E11F17 |
-389.95 |
4.45 |
-9.59 |
-0.85 |
0 |
|
|
379663 |
134455303 |
1 |
SF2O4N5C22H23 |
AB2C4D5E22F23 |
-184.21 |
6.2 |
-8.61 |
-0.87 |
0 |
|
|
379664 |
134455397 |
1 |
ClSF2O3N6C23H23 |
ABC2D3E6F23G23 |
-119.14 |
6.98 |
-8.68 |
-1.03 |
0 |
|
|
379665 |
134455398 |
1 |
O2N7C28H33 |
A2B7C28D33 |
19.71 |
6.21 |
-7.89 |
-0.38 |
0 |
|
|
379666 |
134455427 |
1 |
SO3N5C21H25 |
AB3C5D21E25 |
-31.45 |
5.98 |
-8.45 |
-0.76 |
0 |
|
|
379667 |
134455442 |
1 |
ClSO2N4C21H25 |
ABC2D4E21F25 |
-30.28 |
2.07 |
-8.35 |
-0.58 |
0 |
|
|
379668 |
134455443 |
1 |
ClSN4O4C21H25 |
ABC4D4E21F25 |
-114.22 |
7.21 |
-8.48 |
-0.69 |
0 |