List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
304560 |
124756286 |
1 |
ClO2N3C13H16 |
AB2C3D13E16 |
-62.43 |
3.25 |
-9.73 |
-1.11 |
0 |
|
|
304561 |
124756288 |
3 |
NOC5H7 |
ABC5D7 |
-111.26 |
6.72 |
-8.66 |
-0.04 |
0 |
|
|
304562 |
124756289 |
1 |
SN2O5C17H24 |
AB2C5D17E24 |
-169.39 |
5.27 |
-8.86 |
0.07 |
0 |
|
|
304563 |
124756290 |
1 |
SN2O5C17H24 |
AB2C5D17E24 |
-171.11 |
4.34 |
-8.83 |
0.1 |
0 |
|
|
304564 |
124756293 |
1 |
ON7C14H17 |
AB7C14D17 |
73.56 |
2.02 |
-9.77 |
-1.24 |
0 |
|
|
304565 |
124756295 |
1 |
SN4C13H18 |
AB4C13D18 |
62.42 |
3.47 |
-8.46 |
-0.16 |
0 |
|
|
304566 |
124756297 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-59.35 |
3.35 |
-9.53 |
-0.57 |
0 |
|
|
304567 |
124756308 |
1 |
ON4C15H24 |
AB4C15D24 |
-12.34 |
6.01 |
-8.84 |
0.62 |
0 |
|
|
304568 |
124756312 |
1 |
ON4C19H28 |
AB4C19D28 |
-22.35 |
3.44 |
-8.79 |
-0.02 |
0 |
|
|
304569 |
124756313 |
1 |
O2N5C21H23 |
A2B5C21D23 |
19.86 |
1.64 |
-9.25 |
-1.29 |
0 |
|
|
304570 |
124756316 |
1 |
ClN4C13H17 |
AB4C13D17 |
60.67 |
2.8 |
-9.35 |
-0.2 |
0 |
|
|
304571 |
124756320 |
1 |
O2N5C16H25 |
A2B5C16D25 |
-72.22 |
3.59 |
-9.06 |
0.44 |
0 |
|
|
304572 |
124756321 |
1 |
O2N5C13H19 |
A2B5C13D19 |
-28.36 |
2.7 |
-9.77 |
0.01 |
0 |
|
|
304573 |
124756322 |
1 |
O2N5C13H19 |
A2B5C13D19 |
-27.62 |
7.0 |
-9.77 |
0.11 |
0 |
|
|
304574 |
124756323 |
1 |
O2N5C13H19 |
A2B5C13D19 |
-10.13 |
7.58 |
-9.34 |
-0.6 |
0 |
|
|
304575 |
124756324 |
1 |
O2N5C13H19 |
A2B5C13D19 |
-11.07 |
8.74 |
-9.2 |
-0.56 |
0 |
|
|
304576 |
124756329 |
1 |
OF3N6C16H19 |
AB3C6D16E19 |
-134.84 |
3.88 |
-9.46 |
-1.37 |
0 |
|
|
304577 |
124756331 |
1 |
ON7C14H19 |
AB7C14D19 |
44.99 |
2.33 |
-9.25 |
-0.32 |
0 |
|
|
304578 |
124756332 |
1 |
ON7C14H19 |
AB7C14D19 |
41.84 |
2.12 |
-9.18 |
-0.29 |
0 |
|
|
304581 |
124756342 |
1 |
PO2C26H33 |
AB2C26D33 |
-95.7 |
3.8 |
-9.08 |
0.01 |
0 |
|
|
304582 |
124756344 |
1 |
O3N4C11H16 |
A3B4C11D16 |
-101.95 |
3.6 |
-9.39 |
-0.41 |
0 |
|
|
304583 |
124756349 |
1 |
SN3O3C18H21 |
AB3C3D18E21 |
-79.26 |
6.01 |
-9.34 |
-1.01 |
0 |
|
|
304585 |
124756355 |
1 |
OF2N3C17H25 |
AB2C3D17E25 |
-128.27 |
2.43 |
-8.76 |
-0.45 |
0 |
|
|
304586 |
124756356 |
1 |
OF2N3C17H25 |
AB2C3D17E25 |
-128.47 |
2.82 |
-8.63 |
-0.48 |
0 |
|
|
304587 |
124756363 |
1 |
O2N3C18H27 |
A2B3C18D27 |
-65.89 |
2.69 |
-8.83 |
-0.22 |
0 |
|
|
304588 |
124756366 |
1 |
SO2N3C19H27 |
AB2C3D19E27 |
-61.47 |
1.57 |
-8.72 |
-0.43 |
0 |
|
|
304589 |
124756412 |
1 |
NO2C16H17 |
AB2C16D17 |
-12.27 |
2.54 |
-8.68 |
0.27 |
0 |
|
|
304590 |
124756413 |
1 |
NO2C16H17 |
AB2C16D17 |
-10.64 |
2.17 |
-8.8 |
0.18 |
0 |
|
|
304591 |
124756419 |
2 |
NOC9H11 |
ABC9D11 |
-36.5 |
7.94 |
-8.25 |
0.1 |
0 |
|
|
304592 |
124756420 |
2 |
NOC9H11 |
ABC9D11 |
-36.19 |
7.65 |
-8.26 |
0.09 |
0 |
|
|
304593 |
124756421 |
1 |
FO3N6C16H21 |
AB3C6D16E21 |
-67.99 |
5.45 |
-9.05 |
-0.6 |
0 |
|
|
304594 |
124756426 |
1 |
OS2N7C14H21 |
AB2C7D14E21 |
37.64 |
4.97 |
-8.39 |
-0.65 |
0 |
|
|
304595 |
124756429 |
1 |
ON4C20H28 |
AB4C20D28 |
-9.74 |
2.88 |
-8.89 |
0.4 |
0 |
|
|
304596 |
124756433 |
1 |
ClFNO2C15H19 |
ABCD2E15F19 |
-141.84 |
4.02 |
-9.35 |
-0.4 |
0 |
|
|
304597 |
124756435 |
1 |
ClNO2C15H20 |
ABC2D15E20 |
-95.38 |
5.48 |
-9.28 |
-0.12 |
0 |
|
|
304599 |
124756449 |
1 |
NO3C17H27 |
AB3C17D27 |
-116.13 |
3.99 |
-8.39 |
0.28 |
0 |
|
|
304600 |
124756452 |
1 |
ON4C19H28 |
AB4C19D28 |
28.0 |
6.81 |
-8.68 |
0.54 |
0 |
|
|
304601 |
124756459 |
1 |
OSN5C15H21 |
ABC5D15E21 |
24.88 |
9.68 |
-9.46 |
-0.66 |
0 |
|
|
304602 |
124756462 |
1 |
O3N4C15H16 |
A3B4C15D16 |
39.05 |
5.31 |
-9.31 |
-1.18 |
0 |
|
|
304603 |
124756469 |
1 |
N3O3C19H27 |
A3B3C19D27 |
-117.44 |
7.31 |
-9.24 |
-0.56 |
0 |
|
|
304604 |
124756471 |
1 |
N3O3C17H25 |
A3B3C17D25 |
-49.93 |
5.35 |
-9.05 |
-0.24 |
0 |
|
|
304605 |
124756480 |
1 |
ON6C18H22 |
AB6C18D22 |
90.05 |
5.5 |
-9.35 |
-1.11 |
0 |
|
|
304606 |
124756482 |
1 |
S2N3O3C16H21 |
A2B3C3D16E21 |
-86.82 |
7.59 |
-8.94 |
-0.12 |
0 |
|
|
304607 |
124756494 |
1 |
ON6C18H24 |
AB6C18D24 |
34.04 |
7.69 |
-8.8 |
-0.69 |
0 |
|
|
304608 |
124756496 |
1 |
O2N5C17H25 |
A2B5C17D25 |
-4.63 |
5.94 |
-9.01 |
-0.44 |
0 |
|
|
304609 |
124756503 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-52.61 |
4.78 |
-8.52 |
-0.16 |
0 |
|
|
304610 |
124756508 |
1 |
ON5C17H21 |
AB5C17D21 |
9.92 |
4.71 |
-8.67 |
-0.32 |
0 |
|
|
304611 |
124756510 |
1 |
FOSN4C18H23 |
ABCD4E18F23 |
-35.34 |
2.14 |
-9.15 |
-1.04 |
0 |
|
|
304612 |
124756511 |
1 |
FOSN4C18H23 |
ABCD4E18F23 |
-36.41 |
3.18 |
-9.11 |
-0.94 |
0 |
|
|
304613 |
124756790 |
1 |
OSN2C14H24 |
ABC2D14E24 |
-40.97 |
2.39 |
-8.72 |
-0.2 |
0 |
|
|
304614 |
124765980 |
1 |
FN2O6C26H27 |
AB2C6D26E27 |
-234.2 |
4.28 |
-8.45 |
-0.48 |
0 |
|
|
304615 |
124765981 |
1 |
N2O5C18H22 |
A2B5C18D22 |
-195.53 |
5.06 |
-9.3 |
-0.26 |
0 |
|
|
304616 |
124765982 |
1 |
N2O5C18H22 |
A2B5C18D22 |
-181.62 |
4.67 |
-9.3 |
-0.2 |
0 |
|
|
304617 |
124765983 |
1 |
N2O7C27H30 |
A2B7C27D30 |
-223.91 |
6.71 |
-8.62 |
-0.5 |
0 |
|
|
304618 |
124765984 |
1 |
N2O7C27H30 |
A2B7C27D30 |
-236.84 |
7.45 |
-8.68 |
-0.52 |
0 |
|
|
304620 |
124765987 |
1 |
N3O4C30H33 |
A3B4C30D33 |
-110.34 |
5.72 |
-8.6 |
-0.39 |
0 |
|
|
304621 |
124765988 |
1 |
N3O4C30H33 |
A3B4C30D33 |
-105.92 |
9.87 |
-8.44 |
-0.75 |
0 |
|
|
304622 |
124765989 |
1 |
N2O7C23H32 |
A2B7C23D32 |
-276.8 |
3.39 |
-8.76 |
-0.22 |
0 |
|
|
304625 |
124765992 |
1 |
N2O5C18H22 |
A2B5C18D22 |
-185.48 |
1.43 |
-9.38 |
-0.13 |
0 |
|
|
304626 |
124765993 |
1 |
ClN2O4C16H17 |
AB2C4D16E17 |
-137.96 |
2.48 |
-9.57 |
-0.33 |
0 |
|
|
304627 |
124765994 |
1 |
ClN2O4C16H17 |
AB2C4D16E17 |
-157.21 |
1.99 |
-9.65 |
-0.56 |
0 |
|
|
304628 |
124765995 |
1 |
SN2O4H20C24 |
AB2C4D20E24 |
-75.0 |
3.63 |
-9.16 |
-0.57 |
0 |
|
|
304629 |
124765997 |
1 |
O7C16H26 |
A7B16C26 |
-332.82 |
1.58 |
-10.3 |
0.79 |
0 |
|
|
304630 |
124765998 |
1 |
N2O6C17H20 |
A2B6C17D20 |
-220.76 |
3.54 |
-9.21 |
-0.17 |
0 |
|
|
304631 |
124765999 |
2 |
NO4C13H14 |
AB4C13D14 |
-266.01 |
6.83 |
-8.51 |
-0.19 |
0 |
|
|
304632 |
124766000 |
2 |
NO4C13H14 |
AB4C13D14 |
-253.41 |
6.32 |
-8.4 |
-0.17 |
0 |
|
|
304635 |
124766003 |
1 |
SN2O6C26H28 |
AB2C6D26E28 |
-198.12 |
1.3 |
-8.69 |
-0.54 |
0 |
|
|
304636 |
124766004 |
1 |
SN2O6C26H28 |
AB2C6D26E28 |
-177.12 |
3.42 |
-8.52 |
-0.26 |
0 |
|
|
304637 |
124766005 |
1 |
N3O4C25H29 |
A3B4C25D29 |
-105.76 |
4.76 |
-8.27 |
0.14 |
0 |
|
|
304638 |
124766006 |
1 |
N3O4C25H29 |
A3B4C25D29 |
-129.13 |
3.93 |
-8.28 |
-0.16 |
0 |
|
|
304643 |
124766011 |
1 |
FN2O5C27H29 |
AB2C5D27E29 |
-209.38 |
6.71 |
-9.43 |
-0.59 |
0 |
|
|
304644 |
124766012 |
1 |
FN2O5C27H29 |
AB2C5D27E29 |
-221.76 |
6.65 |
-9.46 |
-0.62 |
0 |
|
|
304645 |
124766013 |
1 |
O4H14C15 |
A4B14C15 |
-138.53 |
6.18 |
-9.93 |
-0.48 |
0 |
|
|
304646 |
124766014 |
1 |
O4H14C15 |
A4B14C15 |
-136.78 |
3.87 |
-9.98 |
-0.47 |
0 |
|
|
304647 |
124766015 |
1 |
O4H14C15 |
A4B14C15 |
-134.48 |
4.38 |
-9.9 |
-0.48 |
0 |
|
|
304648 |
124766016 |
1 |
N2O5C22H30 |
A2B5C22D30 |
-211.4 |
3.98 |
-8.96 |
-0.14 |
0 |
|
|
304649 |
124766017 |
1 |
N2O5C22H30 |
A2B5C22D30 |
-196.71 |
4.65 |
-9.11 |
-0.21 |
0 |
|
|
304651 |
124766019 |
1 |
FN4O4C27H27 |
AB4C4D27E27 |
-123.87 |
7.75 |
-9.14 |
-0.42 |
0 |
|
|
304652 |
124766020 |
1 |
FN4O4C27H27 |
AB4C4D27E27 |
-125.68 |
2.58 |
-9.27 |
-0.55 |
0 |
|
|
304654 |
124766022 |
1 |
N2O7C27H30 |
A2B7C27D30 |
-231.51 |
9.29 |
-9.04 |
-0.37 |
0 |
|
|
304655 |
124766023 |
1 |
N2O7C27H30 |
A2B7C27D30 |
-245.4 |
8.69 |
-9.04 |
-0.38 |
0 |
|
|
304656 |
124766024 |
1 |
SN3O4H29C30 |
AB3C4D29E30 |
-61.37 |
5.34 |
-9.13 |
-0.26 |
0 |
|
|
304657 |
124766025 |
1 |
SN3O4H29C30 |
AB3C4D29E30 |
-58.39 |
1.41 |
-9.04 |
-0.18 |
0 |
|
|
304658 |
124766026 |
1 |
SN3O4H29C30 |
AB3C4D29E30 |
-57.63 |
2.3 |
-9.21 |
-0.32 |
0 |
|
|
304663 |
124766031 |
1 |
N2O4C25H28 |
A2B4C25D28 |
-140.48 |
3.22 |
-9.14 |
-0.23 |
0 |
|
|
304664 |
124766032 |
1 |
N2O4C25H28 |
A2B4C25D28 |
-123.0 |
3.92 |
-9.07 |
-0.18 |
0 |
|
|
304665 |
124766033 |
1 |
N2O5C19H24 |
A2B5C19D24 |
-181.37 |
1.48 |
-8.91 |
-0.14 |
0 |
|
|
304666 |
124766034 |
1 |
N2O5C19H24 |
A2B5C19D24 |
-201.55 |
4.27 |
-9.05 |
-0.11 |
0 |
|
|
304667 |
124766035 |
1 |
N2O5H24C27 |
A2B5C24D27 |
-133.02 |
4.47 |
-9.18 |
-0.26 |
0 |
|
|
304668 |
124766036 |
1 |
N2O5H24C27 |
A2B5C24D27 |
-115.26 |
3.39 |
-9.19 |
-0.29 |
0 |
|
|
304669 |
124766037 |
1 |
SO4N8C33H42 |
AB4C8D33E42 |
-56.15 |
9.72 |
-9.14 |
-0.6 |
0 |
|
|
304670 |
124766038 |
1 |
N3O4C30H31 |
A3B4C30D31 |
-98.5 |
5.29 |
-8.36 |
-0.09 |
0 |
|
|
304671 |
124766039 |
1 |
N3O4C30H31 |
A3B4C30D31 |
-79.92 |
3.31 |
-8.32 |
-0.03 |
0 |
|
|
304673 |
124766041 |
1 |
N2O5C18H22 |
A2B5C18D22 |
-176.55 |
0.98 |
-8.88 |
-0.11 |
0 |
|
|
304674 |
124766042 |
1 |
N5O5C28H35 |
A5B5C28D35 |
-124.84 |
6.17 |
-8.98 |
-0.48 |
0 |
|
|
304675 |
124766043 |
2 |
NO2C11H11 |
AB2C11D11 |
-124.86 |
2.59 |
-9.27 |
-0.48 |
0 |
|
|
304676 |
124766044 |
2 |
NO2C11H11 |
AB2C11D11 |
-106.66 |
3.85 |
-9.16 |
-0.29 |
0 |
|
|
304677 |
124766045 |
1 |
SN2O4C21H22 |
AB2C4D21E22 |
-110.64 |
1.87 |
-8.85 |
-0.3 |
0 |
|
|
304678 |
124766046 |
1 |
SN2O4C21H22 |
AB2C4D21E22 |
-130.8 |
3.25 |
-8.93 |
-0.63 |
0 |
|
|
304679 |
124766047 |
1 |
FN3O4C25H32 |
AB3C4D25E32 |
-194.03 |
3.27 |
-9.11 |
-0.31 |
0 |