List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
80472 |
49834619 |
1 |
ClOSF2N3C14H14 |
ABCD2E3F14G14 |
-95.73 |
4.4 |
-9.34 |
-1.04 |
0 |
|
|
80473 |
49834633 |
1 |
SO2N5H21C22 |
AB2C5D21E22 |
40.86 |
2.85 |
-8.62 |
-1.0 |
0 |
|
|
80474 |
49834635 |
1 |
OSN3H21C25 |
ABC3D21E25 |
81.24 |
2.94 |
-8.5 |
-0.62 |
0 |
|
|
80475 |
49834648 |
1 |
S2N6O9C37H46 |
A2B6C9D37E46 |
-293.03 |
7.55 |
-9.2 |
-1.49 |
0 |
|
|
80476 |
49834649 |
1 |
FSN6O9C38H45 |
ABC6D9E38F45 |
-297.39 |
11.11 |
-9.26 |
-1.03 |
0 |
|
|
80477 |
49834652 |
1 |
N7O13C24H49 |
A7B13C24D49 |
-571.34 |
7.86 |
-9.33 |
-0.04 |
0 |
|
|
80478 |
49834654 |
2 |
N2O7C12H24 |
A2B7C12D24 |
-655.84 |
5.98 |
-9.31 |
0.39 |
0 |
|
|
80479 |
49834655 |
1 |
IN4O4C29H35 |
AB4C4D29E35 |
-62.67 |
16.14 |
-8.05 |
-0.88 |
1 |
|
|
80480 |
49834662 |
1 |
N3O4C35H40 |
A3B4C35D40 |
-89.24 |
4.23 |
0.0 |
0.0 |
1 |
|
|
80481 |
49834664 |
1 |
BrN3O4C30H35 |
AB3C4D30E35 |
-102.5 |
4.02 |
0.0 |
0.0 |
0 |
|
|
80482 |
49834673 |
1 |
NOSC17H25 |
ABCD17E25 |
-23.06 |
3.81 |
-9.04 |
-0.4 |
0 |
|
|
80483 |
49834680 |
1 |
FO2N4C26H29 |
AB2C4D26E29 |
-86.98 |
4.55 |
-8.77 |
-0.1 |
0 |
|
|
80484 |
49834692 |
3 |
NOC8H11 |
ABC8D11 |
-65.75 |
3.6 |
-8.77 |
0.16 |
0 |
|
|
80485 |
49834696 |
1 |
Cl2O3N5H25C29 |
A2B3C5D25E29 |
3.66 |
7.76 |
-8.77 |
-0.5 |
0 |
|
|
80486 |
49834701 |
1 |
SO2N7H25C32 |
AB2C7D25E32 |
115.42 |
9.07 |
-8.7 |
-1.03 |
0 |
|
|
80487 |
49834709 |
1 |
SO3N4C22H24 |
AB3C4D22E24 |
-48.53 |
9.58 |
-8.64 |
-0.26 |
0 |
|
|
80488 |
49834725 |
1 |
SO3F4N5C25H25 |
AB3C4D5E25F25 |
-243.07 |
8.42 |
-8.95 |
-1.15 |
0 |
|
|
80489 |
49834729 |
1 |
FN2S2O5C25H25 |
AB2C2D5E25F25 |
-187.36 |
7.37 |
-9.62 |
-1.04 |
0 |
|
|
80490 |
49834730 |
1 |
FSN3O5H22C24 |
ABC3D5E22F24 |
-106.97 |
8.47 |
-9.65 |
-1.37 |
0 |
|
|
80491 |
49834731 |
1 |
BrFSN2O3H22C24 |
ABCD2E3F22G24 |
-100.25 |
6.59 |
-8.94 |
-0.92 |
0 |
|
|
80492 |
49834734 |
1 |
O4C33H66 |
A4B33C66 |
-320.58 |
3.85 |
-10.22 |
0.51 |
0 |
|
|
80493 |
49834737 |
1 |
BF3O4C17H20 |
AB3C4D17E20 |
-386.39 |
7.13 |
-10.02 |
-0.86 |
0 |
|
|
80494 |
49834740 |
1 |
NO2F3C28H30 |
AB2C3D28E30 |
-213.7 |
4.23 |
-8.71 |
-0.49 |
0 |
|
|
80495 |
49834768 |
1 |
FN2O2H15C17 |
AB2C2D15E17 |
-65.03 |
5.48 |
-8.74 |
-1.0 |
0 |
|
|
80496 |
49834769 |
1 |
FN2O2C23H25 |
AB2C2D23E25 |
-83.98 |
5.87 |
-8.68 |
-0.96 |
0 |
|
|
80497 |
49834771 |
1 |
FN2O2H19C20 |
AB2C2D19E20 |
-73.98 |
6.67 |
-8.53 |
-0.82 |
0 |
|
|
80498 |
49834777 |
1 |
F2O3N6H20C21 |
A2B3C6D20E21 |
-69.91 |
7.13 |
-8.51 |
-1.14 |
0 |
|
|
80499 |
49834779 |
1 |
F2O4N5H17C20 |
A2B4C5D17E20 |
-106.06 |
4.84 |
-9.12 |
-1.24 |
0 |
|
|
80500 |
49834781 |
1 |
N2S2O11C19H22 |
A2B2C11D19E22 |
-455.26 |
8.62 |
-9.26 |
-1.24 |
0 |
|
|
80501 |
49834791 |
1 |
NOBr2H9C15 |
ABC2D9E15 |
32.64 |
2.76 |
-9.12 |
-1.23 |
0 |
|
|
80502 |
49834804 |
1 |
SO2F3N3C16H18 |
AB2C3D3E16F18 |
-183.03 |
4.79 |
-9.21 |
-0.86 |
0 |
|
|
80503 |
49834806 |
1 |
OSF3N4C15H17 |
ABC3D4E15F17 |
-140.63 |
6.04 |
-9.3 |
-0.98 |
0 |
|
|
80504 |
49834812 |
1 |
SO2F3N3H14C15 |
AB2C3D3E14F15 |
-174.56 |
5.6 |
-9.42 |
-1.22 |
0 |
|
|
80505 |
49834819 |
1 |
SO2N4C22H22 |
AB2C4D22E22 |
5.69 |
2.17 |
-8.41 |
-0.61 |
0 |
|
|
80506 |
49834823 |
1 |
BN2O5C18H19 |
AB2C5D18E19 |
-224.1 |
5.97 |
-9.36 |
-1.0 |
0 |
|
|
80507 |
49834833 |
1 |
FN2O5C23H31 |
AB2C5D23E31 |
-197.28 |
9.1 |
-8.95 |
-0.35 |
0 |
|
|
80508 |
49834840 |
1 |
N5O15C24H47 |
A5B15C24D47 |
-689.59 |
2.04 |
-9.38 |
0.14 |
0 |
|
|
80509 |
49834841 |
1 |
F2N5O13C24H45 |
A2B5C13D24E45 |
-667.19 |
5.71 |
-9.38 |
0.25 |
0 |
|
|
80510 |
49834846 |
1 |
IN3O5C32H40 |
AB3C5D32E40 |
-32.37 |
7.9 |
-8.13 |
-1.38 |
1 |
|
|
80511 |
49834847 |
1 |
N3O5C32H40 |
A3B5C32D40 |
-148.48 |
4.55 |
0.0 |
0.0 |
0 |
|
|
80512 |
49834862 |
1 |
NO2C18H31 |
AB2C18D31 |
-121.97 |
4.15 |
-9.49 |
-0.42 |
0 |
|
|
80513 |
49834875 |
1 |
SF2O6C34H34 |
AB2C6D34E34 |
-291.43 |
10.98 |
-9.59 |
-1.0 |
0 |
|
|
80514 |
49834893 |
1 |
SN4O5C27H36 |
AB4C5D27E36 |
-163.33 |
10.21 |
-8.04 |
-0.52 |
0 |
|
|
80515 |
49834895 |
1 |
SN3O4C25H31 |
AB3C4D25E31 |
-119.36 |
8.17 |
-8.34 |
-0.71 |
0 |
|
|
80516 |
49834897 |
1 |
ClON7H22C23 |
ABC7D22E23 |
66.79 |
0.28 |
-8.67 |
-1.12 |
0 |
|
|
80517 |
49834898 |
1 |
ClON7H22C23 |
ABC7D22E23 |
75.91 |
1.8 |
-8.6 |
-1.11 |
0 |
|
|
80518 |
49834900 |
1 |
O2N7C24H25 |
A2B7C24D25 |
29.58 |
2.92 |
-8.54 |
-1.18 |
0 |
|
|
80519 |
49834904 |
1 |
SN3O5C22H27 |
AB3C5D22E27 |
-152.21 |
4.78 |
-9.79 |
-0.73 |
0 |
|
|
80520 |
49834912 |
1 |
N2F3O3H19C20 |
A2B3C3D19E20 |
-180.41 |
1.78 |
-8.39 |
-0.67 |
0 |
|
|
80521 |
49834917 |
1 |
ON6C25H26 |
AB6C25D26 |
103.64 |
4.42 |
-9.22 |
-0.92 |
0 |
|
|
80522 |
49834918 |
1 |
ON7H19C21 |
AB7C19D21 |
148.01 |
3.73 |
-9.0 |
-0.88 |
0 |
|
|
80523 |
49834921 |
1 |
SO3N5C21H21 |
AB3C5D21E21 |
28.62 |
8.51 |
-9.74 |
-1.14 |
0 |
|
|
80524 |
49834927 |
1 |
ClNOC22H22 |
ABCD22E22 |
1.15 |
2.18 |
-8.3 |
-0.18 |
0 |
|
|
80525 |
49834928 |
1 |
ClNOC22H22 |
ABCD22E22 |
1.65 |
1.12 |
-8.22 |
-0.41 |
0 |
|
|
80526 |
49834935 |
1 |
SO4N5C17H17 |
AB4C5D17E17 |
-18.76 |
3.18 |
-8.41 |
-1.22 |
0 |
|
|
80527 |
49834949 |
1 |
N9C22H29 |
A9B22C29 |
126.05 |
3.15 |
-8.49 |
0.04 |
0 |
|
|
80528 |
49834951 |
1 |
N7O13C40H57 |
A7B13C40D57 |
-472.17 |
3.58 |
-8.83 |
-1.57 |
0 |
|
|
80529 |
49834952 |
1 |
ClO2N5H24C25 |
AB2C5D24E25 |
17.84 |
3.28 |
-9.12 |
-1.03 |
0 |
|
|
80530 |
49834971 |
1 |
SN3O4C23H29 |
AB3C4D23E29 |
-113.59 |
6.62 |
-9.48 |
-0.71 |
0 |
|
|
80531 |
49834974 |
1 |
SN3O5C21H25 |
AB3C5D21E25 |
-117.21 |
7.86 |
-9.78 |
-0.68 |
0 |
|
|
80532 |
49834979 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-38.55 |
4.3 |
-7.89 |
-0.4 |
0 |
|
|
80533 |
49834999 |
1 |
SO4N6C23H28 |
AB4C6D23E28 |
4.83 |
6.05 |
-8.87 |
-2.11 |
0 |
|
|
80534 |
49835006 |
1 |
ON2C13H18 |
AB2C13D18 |
-19.55 |
1.49 |
-9.28 |
0.41 |
0 |
|
|
80535 |
49835010 |
1 |
ON10C25H34 |
AB10C25D34 |
88.54 |
4.3 |
-8.55 |
0.1 |
0 |
|
|
80536 |
49835014 |
1 |
ClFN9C21H25 |
ABC9D21E25 |
78.94 |
2.11 |
-8.68 |
-0.53 |
0 |
|
|
80537 |
49835023 |
1 |
ON3C10H13 |
AB3C10D13 |
23.46 |
1.45 |
-9.52 |
-0.68 |
0 |
|
|
80538 |
49835030 |
1 |
ON7H21C23 |
AB7C21D23 |
105.51 |
6.28 |
-8.64 |
-0.97 |
0 |
|
|
80539 |
49835040 |
1 |
N3O3C20H21 |
A3B3C20D21 |
-14.78 |
4.19 |
-8.25 |
-0.45 |
0 |
|
|
80540 |
49835043 |
1 |
N3O3C21H23 |
A3B3C21D23 |
-30.58 |
4.34 |
-8.31 |
-0.7 |
0 |
|
|
80541 |
49835047 |
1 |
O2N6C25H28 |
A2B6C25D28 |
61.36 |
5.12 |
-9.27 |
-0.96 |
0 |
|
|
80542 |
49835053 |
1 |
SO5N6H18C19 |
AB5C6D18E19 |
-21.95 |
14.19 |
-8.68 |
-1.96 |
0 |
|
|
80543 |
49835054 |
1 |
SN7O7H21C23 |
AB7C7D21E23 |
-59.92 |
13.05 |
-8.52 |
-1.89 |
0 |
|
|
80544 |
49835057 |
3 |
N3C5H5 |
A3B5C5 |
139.1 |
5.95 |
-8.37 |
-1.02 |
0 |
|
|
80545 |
49835065 |
1 |
ON9C21H27 |
AB9C21D27 |
90.07 |
4.58 |
-8.58 |
-0.16 |
0 |
|
|
80546 |
49835066 |
1 |
ON8C23H26 |
AB8C23D26 |
95.08 |
3.1 |
-8.73 |
-0.46 |
0 |
|
|
80547 |
49835074 |
1 |
Cl2S2O5N14C46H58 |
A2B2C5D14E46F58 |
-94.93 |
7.6 |
-8.43 |
-0.86 |
0 |
|
|
80548 |
49835077 |
1 |
O2N7C25H27 |
A2B7C25D27 |
33.05 |
4.83 |
-8.23 |
-0.78 |
0 |
|
|
80549 |
49835078 |
1 |
O3N6H20C22 |
A3B6C20D22 |
17.77 |
5.26 |
-8.49 |
-1.18 |
0 |
|
|
80550 |
49835095 |
1 |
ON4H22C23 |
AB4C22D23 |
61.37 |
5.45 |
-8.16 |
-1.08 |
0 |
|
|
80551 |
49835096 |
3 |
NOC6H7 |
ABC6D7 |
-45.49 |
5.56 |
-8.38 |
-0.49 |
0 |
|
|
80552 |
49835099 |
1 |
O3N4C21H24 |
A3B4C21D24 |
-6.62 |
4.32 |
-9.39 |
-0.82 |
0 |
|
|
80553 |
49835105 |
1 |
O2C23H34 |
A2B23C34 |
-52.98 |
2.01 |
-9.24 |
0.73 |
0 |
|
|
80554 |
49835109 |
1 |
FON8H15C17 |
ABC8D15E17 |
44.34 |
2.22 |
-8.17 |
-1.09 |
0 |
|
|
80555 |
49835112 |
2 |
ON4C7H8 |
AB4C7D8 |
39.87 |
6.96 |
-8.82 |
-1.21 |
0 |
|
|
80556 |
49835116 |
1 |
ClN2O3H15C18 |
AB2C3D15E18 |
-56.19 |
2.57 |
-8.45 |
-1.02 |
0 |
|
|
80557 |
49835117 |
2 |
NOH9C11 |
ABC9D11 |
3.82 |
3.89 |
-8.5 |
-0.91 |
0 |
|
|
80558 |
49835118 |
2 |
NOC10H10 |
ABC10D10 |
-30.0 |
3.02 |
-8.68 |
-0.79 |
0 |
|
|
80559 |
49835124 |
1 |
ON10C26H26 |
AB10C26D26 |
150.4 |
6.51 |
-8.74 |
-0.55 |
0 |
|
|
80560 |
49835125 |
1 |
ON8C21H24 |
AB8C21D24 |
97.9 |
3.06 |
-8.69 |
-0.46 |
0 |
|
|
80561 |
49835130 |
1 |
SN3O4C26H27 |
AB3C4D26E27 |
-97.58 |
6.77 |
-8.51 |
-0.74 |
0 |
|
|
80562 |
49835131 |
1 |
ClO3N5H20C23 |
AB3C5D20E23 |
12.1 |
5.02 |
-8.47 |
-0.94 |
0 |
|
|
80563 |
49835134 |
2 |
ON3H10C11 |
AB3C10D11 |
47.58 |
1.42 |
-8.87 |
-1.11 |
0 |
|
|
80564 |
49835150 |
1 |
O2N4H22C23 |
A2B4C22D23 |
28.15 |
2.21 |
-8.31 |
-0.82 |
0 |
|
|
80565 |
49835152 |
1 |
O3N4C20H22 |
A3B4C20D22 |
-20.63 |
3.83 |
-8.36 |
-0.52 |
0 |
|
|
80566 |
49835164 |
1 |
BrS3N4O7C29H29 |
AB3C4D7E29F29 |
-151.93 |
4.21 |
-8.86 |
-1.44 |
0 |
|
|
80567 |
49835166 |
1 |
ON9C15H17 |
AB9C15D17 |
105.17 |
8.01 |
-9.06 |
-1.16 |
0 |
|
|
80568 |
49835169 |
8 |
NC2H2 |
AB2C2 |
129.95 |
1.69 |
-8.29 |
-0.67 |
0 |
|
|
80569 |
49835186 |
1 |
SO3N5C23H29 |
AB3C5D23E29 |
-68.77 |
2.94 |
-8.57 |
-0.58 |
0 |
|
|
80570 |
49835190 |
1 |
ClSO3N4H23C24 |
ABC3D4E23F24 |
-51.33 |
5.71 |
-8.76 |
-0.96 |
0 |
|
|
80571 |
49835196 |
1 |
O3N7C27H29 |
A3B7C27D29 |
-14.03 |
3.11 |
-8.52 |
-0.84 |
0 |