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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
47425 |
10532567 |
1 |
NSiC47H73 |
ABC47D73 |
-17.0 |
2.17 |
-8.05 |
-0.17 |
0 |
|
|
47426 |
10532586 |
1 |
N4O5C42H42 |
A4B5C42D42 |
-69.38 |
2.75 |
-8.25 |
-0.71 |
0 |
|
|
47427 |
10532600 |
1 |
FSi3N5O5C31H58 |
AB3C5D5E31F58 |
-413.56 |
5.13 |
-8.56 |
-0.66 |
0 |
|
|
47428 |
10532602 |
1 |
NaO9N10C29H29 |
AB9C10D29E29 |
-303.52 |
6.21 |
-8.88 |
-1.41 |
0 |
|
|
47429 |
10532619 |
1 |
N3O9C37H55 |
A3B9C37D55 |
-417.17 |
9.22 |
-9.24 |
-0.69 |
0 |
|
|
47430 |
10532623 |
1 |
ZnN4H36C44 |
AB4C36D44 |
496.43 |
5.99 |
-8.89 |
-1.65 |
0 |
|
|
47431 |
10532637 |
1 |
NO8H41C42 |
AB8C41D42 |
-113.94 |
3.05 |
-9.36 |
-1.92 |
0 |
|
|
47432 |
10532640 |
1 |
BrSi3N4O4C29H55 |
AB3C4D4E29F55 |
-314.16 |
2.67 |
-8.46 |
-0.39 |
0 |
|
|
47433 |
10532643 |
1 |
PN4O8C35H53 |
AB4C8D35E53 |
-459.28 |
4.43 |
-9.18 |
-0.07 |
0 |
|
|
47434 |
10532650 |
1 |
N2Si3O6C35H60 |
A2B3C6D35E60 |
-433.54 |
6.13 |
-8.7 |
-0.43 |
0 |
|
|
47435 |
10532657 |
1 |
N5O7C37H63 |
A5B7C37D63 |
-376.68 |
6.45 |
-9.34 |
-0.33 |
0 |
|
|
47436 |
10532661 |
2 |
N2O2H21C22 |
A2B2C21D22 |
-26.92 |
6.02 |
-8.07 |
-0.12 |
0 |
|
|
47437 |
10532663 |
1 |
ClF3N4O4H34C37 |
AB3C4D4E34F37 |
-245.76 |
5.26 |
-8.74 |
-0.93 |
0 |
|
|
47438 |
10532674 |
1 |
N2O10H36C39 |
A2B10C36D39 |
-287.73 |
4.03 |
-8.47 |
-0.86 |
0 |
|
|
47439 |
10532675 |
1 |
IN2S3H33C34 |
AB2C3D33E34 |
144.47 |
17.06 |
-6.95 |
-1.95 |
0 |
|
|
47440 |
10532681 |
1 |
Si2O3N8C35H56 |
A2B3C8D35E56 |
-181.8 |
5.09 |
-8.49 |
-0.1 |
0 |
|
|
47442 |
10532689 |
1 |
SSiN3O7C36H47 |
ABC3D7E36F47 |
-219.49 |
4.54 |
-8.92 |
-1.33 |
0 |
|
|
47443 |
10532690 |
1 |
NO7C42H63 |
AB7C42D63 |
-285.23 |
6.18 |
-9.21 |
0.3 |
0 |
|
|
47444 |
10532693 |
1 |
N4O6H26C43 |
A4B6C26D43 |
117.18 |
8.08 |
-8.78 |
-1.72 |
0 |
|
|
47445 |
10532719 |
2 |
SO3N5C15H18 |
AB3C5D15E18 |
-105.22 |
5.4 |
-7.9 |
-1.18 |
0 |
|
|
47446 |
10532731 |
1 |
N5O9C35H63 |
A5B9C35D63 |
-500.94 |
6.44 |
-10.12 |
-0.17 |
0 |
|
|
47447 |
10532767 |
2 |
N2O3C21H23 |
A2B3C21D23 |
-116.5 |
4.3 |
-7.78 |
-1.42 |
0 |
|
|
47448 |
10532768 |
1 |
Cl3N3O7C34H34 |
A3B3C7D34E34 |
-240.07 |
6.12 |
-9.53 |
-1.0 |
0 |
|
|
47449 |
10532784 |
1 |
Br2N5H31C37 |
A2B5C31D37 |
162.56 |
9.82 |
-7.51 |
-1.13 |
0 |
|
|
47450 |
10532787 |
1 |
BrSN2O8C33H41 |
ABC2D8E33F41 |
-225.4 |
5.87 |
-8.81 |
-0.6 |
0 |
|
|
47451 |
10532804 |
1 |
NPO10C36H70 |
ABC10D36E70 |
-622.47 |
15.1 |
-9.76 |
-0.16 |
0 |
|
|
47452 |
10532841 |
2 |
NSiO4C18H33 |
ABC4D18E33 |
-532.47 |
4.22 |
-8.75 |
-0.46 |
0 |
|
|
47453 |
10532853 |
2 |
BrS2C16H20 |
AB2C16D20 |
40.17 |
2.61 |
-8.92 |
-1.11 |
0 |
|
|
47454 |
10532873 |
2 |
N2O5C19H21 |
A2B5C19D21 |
-322.59 |
4.61 |
-7.99 |
-1.82 |
0 |
|
|
47455 |
10532877 |
1 |
ClCuSN3O9C30H39 |
ABCD3E9F30G39 |
-307.52 |
10.44 |
-8.54 |
-1.13 |
0 |
|
|
47456 |
10532884 |
1 |
Si3N5O6C34H57 |
A3B5C6D34E57 |
-408.88 |
2.53 |
-8.77 |
-0.31 |
0 |
|
|
47457 |
10532885 |
1 |
SiB2S2F8C33H54 |
AB2C2D8E33F54 |
-708.59 |
13.81 |
-8.53 |
-1.7 |
1 |
|
|
47458 |
10532904 |
1 |
SC41H49 |
AB41C49 |
83.97 |
0.36 |
0.0 |
0.0 |
0 |
|
|
47459 |
10532919 |
1 |
O21C28H48 |
A21B28C48 |
-942.6 |
6.97 |
-10.01 |
0.2 |
1 |
|
|
47460 |
10532929 |
1 |
TeN2O6C26H31 |
AB2C6D26E31 |
-169.15 |
2.21 |
0.0 |
0.0 |
0 |
|
|
47461 |
10532941 |
1 |
O7N9C36H53 |
A7B9C36D53 |
-264.55 |
8.55 |
-9.01 |
-0.57 |
0 |
|
|
47462 |
10532944 |
1 |
NCl3O15C27H40 |
AB3C15D27E40 |
-660.53 |
5.48 |
-9.68 |
-0.5 |
0 |
|
|
47463 |
10532955 |
1 |
Si2O9C38H70 |
A2B9C38D70 |
-534.61 |
3.42 |
-8.92 |
0.18 |
0 |
|
|
47464 |
10532960 |
2 |
INOH15C16 |
ABCD15E16 |
83.24 |
2.41 |
-8.39 |
-1.75 |
0 |
|
|
47465 |
10532962 |
1 |
SO11H28C41 |
AB11C28D41 |
-252.73 |
3.76 |
-9.65 |
-1.44 |
0 |
|
|
47466 |
10532968 |
1 |
O13C38H64 |
A13B38C64 |
-661.33 |
8.87 |
-9.88 |
0.2 |
0 |
|
|
47468 |
10533034 |
1 |
N4O7C43H56 |
A4B7C43D56 |
-233.43 |
6.89 |
-8.22 |
-0.25 |
0 |
|
|
47469 |
10533037 |
1 |
NCl3O10C34H52 |
AB3C10D34E52 |
-510.82 |
4.58 |
-10.02 |
-0.96 |
0 |
|
|
47470 |
10533064 |
1 |
SiO11C40H60 |
AB11C40D60 |
-407.87 |
4.94 |
-9.24 |
-0.02 |
0 |
|
|
47472 |
10533087 |
1 |
NPO7C42H86 |
ABC7D42E86 |
-440.59 |
16.74 |
-6.51 |
-0.51 |
0 |
|
|
47473 |
10533092 |
2 |
OS2N6C16H18 |
AB2C6D16E18 |
177.91 |
6.59 |
-8.71 |
-0.86 |
0 |
|
|
47474 |
10533099 |
1 |
F3S3O9H33C35 |
A3B3C9D33E35 |
-453.13 |
11.96 |
-8.93 |
-0.83 |
0 |
|
|
47475 |
10533125 |
1 |
SiF3N4O7C38H45 |
AB3C4D7E38F45 |
-408.57 |
8.81 |
-8.89 |
-0.61 |
0 |
|
|
47476 |
10533152 |
3 |
NO2C15H27 |
AB2C15D27 |
-387.05 |
4.86 |
-9.55 |
0.12 |
0 |
|
|
47477 |
10533158 |
1 |
FN2O6C47H53 |
AB2C6D47E53 |
-258.09 |
9.27 |
-8.43 |
-0.13 |
0 |
|
|
47478 |
10533161 |
4 |
OC13H18 |
AB13C18 |
-211.35 |
2.81 |
-8.31 |
0.36 |
0 |
|
|
47479 |
10533197 |
1 |
O13C41H66 |
A13B41C66 |
-659.8 |
6.93 |
-9.59 |
0.16 |
0 |
|
|
47480 |
10533229 |
1 |
FO5N12C38H51 |
AB5C12D38E51 |
-200.79 |
7.65 |
-8.65 |
-0.25 |
0 |
|
|
47481 |
10533241 |
1 |
S2O9N10C32H44 |
A2B9C10D32E44 |
-363.35 |
10.28 |
-8.74 |
-1.57 |
0 |
|
|
47482 |
10533245 |
1 |
S2N3O6C44H47 |
A2B3C6D44E47 |
-135.46 |
5.23 |
-8.51 |
-0.97 |
2 |
|
|
47483 |
10533257 |
1 |
FePN2O4C46H49 |
ABC2D4E46F49 |
-141.94 |
3.28 |
-7.24 |
-0.39 |
0 |
|
|
47484 |
10533259 |
1 |
O14C41H64 |
A14B41C64 |
-679.17 |
3.65 |
-9.7 |
0.03 |
0 |
|
|
47485 |
10533266 |
2 |
NOSeC12H17 |
ABCD12E17 |
52.41 |
8.12 |
-8.18 |
-1.89 |
0 |
|
|
47486 |
10533268 |
1 |
P2S2N10O13C23H32 |
A2B2C10D13E23F32 |
-567.54 |
9.22 |
-9.02 |
-0.9 |
0 |
|
|
47487 |
10533286 |
2 |
N2O3C24H29 |
A2B3C24D29 |
-201.3 |
4.12 |
-9.41 |
-0.17 |
0 |
|
|
47489 |
10533299 |
1 |
SiN3O7C45H67 |
AB3C7D45E67 |
-348.38 |
6.24 |
-8.76 |
-1.29 |
0 |
|
|
47490 |
10533301 |
2 |
ON4H15C23 |
AB4C15D23 |
287.91 |
4.89 |
-7.52 |
-2.02 |
0 |
|
|
47491 |
10533384 |
1 |
S2N7O11C35H47 |
A2B7C11D35E47 |
-463.2 |
6.36 |
-8.98 |
-1.46 |
0 |
|
|
47492 |
10533391 |
1 |
PS2N3O8C41H50 |
AB2C3D8E41F50 |
-324.66 |
4.07 |
-8.71 |
-0.42 |
0 |
|
|
47493 |
10533414 |
2 |
N4O5C20H29 |
A4B5C20D29 |
-443.03 |
8.69 |
-9.16 |
-0.2 |
0 |
|
|
47494 |
10533426 |
1 |
SN8O13C34H52 |
AB8C13D34E52 |
-568.18 |
4.34 |
-9.93 |
-1.93 |
1 |
|
|
47495 |
10533427 |
1 |
N8O9C33H49 |
A8B9C33D49 |
-390.6 |
5.03 |
0.0 |
0.0 |
0 |
|
|
47497 |
10533446 |
1 |
ClNSiS4O5C39H62 |
ABCD4E5F39G62 |
-183.8 |
5.9 |
-7.84 |
-0.48 |
0 |
|
|
47498 |
10533449 |
1 |
N5O14C39H55 |
A5B14C39D55 |
-639.68 |
6.11 |
-9.29 |
-0.38 |
0 |
|
|
47499 |
10533458 |
1 |
SiN9O11C36H57 |
AB9C11D36E57 |
-346.12 |
3.68 |
-8.66 |
-0.4 |
0 |
|
|
47500 |
10533464 |
1 |
F3N4O16H31C35 |
A3B4C16D31E35 |
-520.22 |
4.05 |
-10.9 |
-2.38 |
0 |
|
|
47502 |
10533530 |
1 |
N2S2F6C29H30 |
A2B2C6D29E30 |
-121.19 |
13.3 |
-3.56 |
-0.9 |
0 |
|
|
47503 |
10533537 |
1 |
S2F6O8C41H42 |
A2B6C8D41E42 |
-526.53 |
6.8 |
-8.43 |
-1.37 |
0 |
|
|
47504 |
10533540 |
2 |
SO2N5C21H34 |
AB2C5D21E34 |
-76.68 |
5.06 |
-8.14 |
-1.06 |
0 |
|
|
47505 |
10533542 |
1 |
S2N7O7C43H51 |
A2B7C7D43E51 |
-190.61 |
9.29 |
-9.19 |
-0.99 |
0 |
|
|
47506 |
10533543 |
1 |
N3O8C50H71 |
A3B8C50D71 |
-266.32 |
10.23 |
-8.47 |
0.08 |
0 |
|
|
47507 |
10533612 |
2 |
N4O4H13C22 |
A4B4C13D22 |
270.74 |
3.02 |
-8.99 |
-2.93 |
0 |
|
|
47508 |
10533628 |
1 |
NPO12C45H84 |
ABC12D45E84 |
-693.73 |
14.61 |
-9.72 |
-0.24 |
0 |
|
|
47509 |
10533630 |
1 |
FN8O9C44H59 |
AB8C9D44E59 |
-389.21 |
2.62 |
-9.02 |
-0.35 |
0 |
|
|
47510 |
10533635 |
1 |
S2N7O7H37C46 |
A2B7C7D37E46 |
68.72 |
10.42 |
-8.83 |
-1.26 |
0 |
|
|
47511 |
10533638 |
2 |
NCl2O7C18H19 |
AB2C7D18E19 |
-606.32 |
3.59 |
-9.63 |
-2.09 |
0 |
|
|
47512 |
10533656 |
1 |
PN5O12C44H46 |
AB5C12D44E46 |
-449.3 |
2.03 |
-9.56 |
-0.46 |
0 |
|
|
47513 |
10533669 |
1 |
BrPO10C46H50 |
ABC10D46E50 |
-383.97 |
6.28 |
-9.28 |
-1.05 |
0 |
|
|
47514 |
10533674 |
1 |
ClNSiS2O10C42H68 |
ABCD2E10F42G68 |
-481.65 |
6.89 |
-8.34 |
-0.4 |
0 |
|
|
47515 |
10533677 |
1 |
Si3O6C50H94 |
A3B6C50D94 |
-556.54 |
1.52 |
-8.23 |
0.75 |
0 |
|
|
47516 |
10533680 |
2 |
ClSO2F3N3H12C19 |
ABC2D3E3F12G19 |
-262.57 |
3.55 |
-9.07 |
-2.15 |
0 |
|
|
47517 |
10533682 |
2 |
N4O7C20H31 |
A4B7C20D31 |
-690.36 |
5.47 |
-9.39 |
-0.25 |
0 |
|
|
47518 |
10533752 |
2 |
O11C21H23 |
A11B21C23 |
-855.52 |
7.4 |
-9.34 |
-1.3 |
0 |
|
|
47519 |
10533762 |
1 |
N11O12C41H67 |
A11B12C41D67 |
-587.36 |
4.58 |
-9.53 |
-0.1 |
0 |
|
|
47521 |
10533800 |
1 |
O15C50H78 |
A15B50C78 |
-753.0 |
4.5 |
-8.84 |
0.52 |
0 |
|
|
47522 |
10533808 |
1 |
Si5O7C48H92 |
A5B7C48D92 |
-597.53 |
2.11 |
-8.82 |
0.18 |
0 |
|
|
47523 |
10533819 |
1 |
PSiS2N5O8C46H52 |
ABC2D5E8F46G52 |
-285.83 |
6.84 |
-8.72 |
-0.98 |
0 |
|
|
47524 |
10533829 |
1 |
Cl2S2N3O6C50H55 |
A2B2C3D6E50F55 |
-186.48 |
6.95 |
-8.59 |
-0.68 |
0 |
|
|
47525 |
10533874 |
2 |
BrO2C27H37 |
AB2C27D37 |
-66.76 |
6.26 |
-7.28 |
-0.02 |
0 |
|
|
47526 |
10533881 |
1 |
NO16C50H77 |
AB16C50D77 |
-679.3 |
7.71 |
-9.39 |
-0.96 |
0 |
|
|
47527 |
10533886 |
1 |
FN3O7H56C60 |
AB3C7D56E60 |
-228.06 |
2.14 |
-9.43 |
-1.13 |
0 |
|
|
47528 |
10533891 |
2 |
N4O7C23H32 |
A4B7C23D32 |
-630.42 |
0.82 |
-9.47 |
-0.64 |
0 |
|
|
47529 |
10533892 |
1 |
P2O9C57H62 |
A2B9C57D62 |
-392.23 |
3.47 |
-8.48 |
-0.1 |
0 |
|
|
47530 |
10533896 |
1 |
N7O14C47H67 |
A7B14C47D67 |
-622.01 |
6.06 |
-9.52 |
-0.46 |
0 |
|
|
47531 |
10533898 |
1 |
N6O8C57H58 |
A6B8C57D58 |
-136.18 |
10.45 |
-9.24 |
-1.24 |
0 |