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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
426460 |
135144297 |
1 |
SO3N4H16C21 |
AB3C4D16E21 |
57.3 |
7.5 |
-9.58 |
-1.7 |
0 |
|
|
426461 |
135144298 |
1 |
O3N6H18C22 |
A3B6C18D22 |
14.94 |
2.78 |
-8.74 |
-1.48 |
0 |
|
|
426462 |
135144299 |
1 |
FSN3O3H16C20 |
ABC3D3E16F20 |
-43.9 |
13.0 |
-8.86 |
-0.88 |
0 |
|
|
426463 |
135144300 |
1 |
FCl2N4C10H13 |
AB2C4D10E13 |
-32.47 |
1.51 |
-8.55 |
-0.46 |
0 |
|
|
426464 |
135144301 |
1 |
FN6H19C22 |
AB6C19D22 |
96.2 |
3.67 |
-8.59 |
-0.77 |
0 |
|
|
426465 |
135144307 |
2 |
NH18C21 |
AB18C21 |
128.73 |
1.28 |
-8.66 |
-1.07 |
0 |
|
|
426466 |
135144309 |
1 |
NH21C22 |
AB21C22 |
56.05 |
2.66 |
-8.6 |
-1.0 |
0 |
|
|
426467 |
135144310 |
1 |
N2H22C35 |
A2B22C35 |
169.17 |
1.62 |
-8.71 |
-1.24 |
0 |
|
|
426468 |
135144311 |
1 |
NH17C20 |
AB17C20 |
65.43 |
2.8 |
-8.6 |
-1.01 |
0 |
|
|
426469 |
135144314 |
1 |
N3C17H19 |
A3B17C19 |
71.76 |
4.02 |
-8.24 |
-1.02 |
0 |
|
|
426470 |
135144317 |
1 |
N2C49H50 |
A2B49C50 |
92.87 |
2.88 |
-8.62 |
-1.04 |
0 |
|
|
426471 |
135144319 |
1 |
NC27H31 |
AB27C31 |
30.94 |
2.87 |
-8.6 |
-1.01 |
0 |
|
|
426472 |
135144320 |
2 |
NH16C20 |
AB16C20 |
138.26 |
0.66 |
-8.68 |
-1.1 |
0 |
|
|
426473 |
135144321 |
1 |
N2H30C39 |
A2B30C39 |
143.2 |
3.24 |
-8.64 |
-1.12 |
0 |
|
|
426474 |
135144322 |
1 |
NH17C25 |
AB17C25 |
120.68 |
2.52 |
-8.67 |
-1.09 |
0 |
|
|
426475 |
135144323 |
2 |
NC24H24 |
AB24C24 |
97.82 |
0.37 |
-8.63 |
-1.04 |
0 |
|
|
426476 |
135144371 |
1 |
F3N5C23H28 |
A3B5C23D28 |
-81.83 |
7.4 |
-8.65 |
-0.68 |
0 |
|
|
426477 |
135144407 |
1 |
FON3C19H20 |
ABC3D19E20 |
-4.1 |
2.04 |
-8.48 |
-0.76 |
0 |
|
|
426478 |
135144410 |
1 |
N5C26H35 |
A5B26C35 |
64.5 |
6.5 |
-8.28 |
-0.15 |
0 |
|
|
426479 |
135144412 |
1 |
ON5C19H23 |
AB5C19D23 |
50.36 |
6.9 |
-7.98 |
-0.74 |
0 |
|
|
426480 |
135144413 |
1 |
FSN2H17C21 |
ABC2D17E21 |
59.52 |
2.49 |
-8.36 |
-1.06 |
0 |
|
|
426481 |
135144421 |
2 |
N2C11H14 |
A2B11C14 |
52.86 |
6.95 |
-8.17 |
-0.32 |
0 |
|
|
426482 |
135144422 |
1 |
N5C25H33 |
A5B25C33 |
69.64 |
6.0 |
-8.29 |
-0.28 |
0 |
|
|
426483 |
135144423 |
1 |
ON5C26H35 |
AB5C26D35 |
27.23 |
7.84 |
-8.3 |
-0.01 |
0 |
|
|
426484 |
135144424 |
1 |
N6C27H38 |
A6B27C38 |
77.35 |
7.89 |
-8.01 |
-0.1 |
0 |
|
|
426485 |
135144425 |
1 |
FON2H15C20 |
ABC2D15E20 |
25.79 |
2.97 |
-8.45 |
-1.08 |
0 |
|
|
426486 |
135144426 |
1 |
FN2C22H25 |
AB2C22D25 |
7.56 |
2.27 |
-8.24 |
-0.77 |
0 |
|
|
426487 |
135144427 |
1 |
ClN4C19H23 |
AB4C19D23 |
67.44 |
6.44 |
-8.48 |
-0.82 |
0 |
|
|
426488 |
135144428 |
1 |
FN2C19H21 |
AB2C19D21 |
11.73 |
2.15 |
-8.22 |
-0.79 |
0 |
|
|
426489 |
135144429 |
1 |
ClN4C24H31 |
AB4C24D31 |
61.24 |
6.71 |
-8.82 |
-0.42 |
0 |
|
|
426490 |
135144430 |
1 |
N6C25H34 |
A6B25C34 |
86.52 |
7.14 |
-7.95 |
-0.18 |
0 |
|
|
426491 |
135144431 |
2 |
N2C9H10 |
A2B9C10 |
84.04 |
6.49 |
-8.35 |
-0.51 |
0 |
|
|
426492 |
135144432 |
2 |
N2C10H13 |
A2B10C13 |
68.28 |
4.99 |
-8.2 |
-0.67 |
0 |
|
|
426493 |
135144436 |
1 |
ON4C21H26 |
AB4C21D26 |
44.78 |
6.53 |
-8.0 |
-0.27 |
0 |
|
|
426494 |
135144442 |
1 |
N5C29H39 |
A5B29C39 |
61.91 |
6.5 |
-7.97 |
-0.19 |
0 |
|
|
426495 |
135144443 |
1 |
ClN4C22H31 |
AB4C22D31 |
33.83 |
2.55 |
-8.22 |
0.08 |
0 |
|
|
426496 |
135144444 |
1 |
BrN4C19H21 |
AB4C19D21 |
83.65 |
9.41 |
-8.44 |
-0.56 |
0 |
|
|
426497 |
135144445 |
1 |
N5C28H39 |
A5B28C39 |
43.61 |
7.19 |
-7.93 |
-0.51 |
0 |
|
|
426498 |
135144446 |
1 |
N5C28H39 |
A5B28C39 |
44.71 |
7.61 |
-8.72 |
-0.27 |
0 |
|
|
426499 |
135144447 |
1 |
N5C28H39 |
A5B28C39 |
47.16 |
6.24 |
-8.77 |
-0.53 |
0 |
|
|
426500 |
135144448 |
1 |
N5C23H29 |
A5B23C29 |
70.95 |
6.32 |
-8.17 |
-0.76 |
0 |
|
|
426501 |
135144449 |
1 |
SN5C28H33 |
AB5C28D33 |
101.67 |
9.74 |
-8.22 |
-0.63 |
0 |
|
|
426502 |
135144538 |
1 |
NO4C26H31 |
AB4C26D31 |
-111.86 |
2.63 |
-8.39 |
0.12 |
0 |
|
|
426503 |
135144539 |
1 |
SN2O4C9H24 |
AB2C4D9E24 |
-218.56 |
6.25 |
-10.26 |
0.08 |
0 |
|
|
426504 |
135144541 |
1 |
SN2O4C9H24 |
AB2C4D9E24 |
-208.5 |
1.78 |
-9.38 |
-0.77 |
0 |
|
|
426505 |
135144544 |
1 |
ClN2C12H21 |
AB2C12D21 |
-30.71 |
3.65 |
-8.06 |
0.23 |
0 |
|
|
426506 |
135144550 |
1 |
O3N5C17H17 |
A3B5C17D17 |
-30.97 |
7.68 |
-7.96 |
-0.27 |
0 |
|
|
426507 |
135144551 |
1 |
O3N5C17H17 |
A3B5C17D17 |
-41.68 |
5.63 |
-8.1 |
-0.39 |
0 |
|
|
426508 |
135144559 |
1 |
NO6H23C26 |
AB6C23D26 |
-168.98 |
7.45 |
-9.13 |
-1.33 |
0 |
|
|
426509 |
135144560 |
1 |
NO6C17H19 |
AB6C17D19 |
-223.84 |
7.57 |
-9.59 |
-1.35 |
0 |
|
|
426510 |
135144561 |
1 |
NO6C23H23 |
AB6C23D23 |
-186.2 |
6.86 |
-9.13 |
-1.46 |
0 |
|
|
426511 |
135144562 |
1 |
O3N5C24H37 |
A3B5C24D37 |
-128.95 |
4.21 |
-8.59 |
-0.53 |
0 |
|
|
426512 |
135144564 |
2 |
NO2C10H15 |
AB2C10D15 |
-175.06 |
5.63 |
-9.16 |
-0.13 |
0 |
|
|
426513 |
135144565 |
1 |
N3O5C15H21 |
A3B5C15D21 |
-196.09 |
4.41 |
-8.47 |
-0.33 |
0 |
|
|
426514 |
135144573 |
1 |
O3N5C18H27 |
A3B5C18D27 |
-109.41 |
2.37 |
-9.06 |
-0.51 |
0 |
|
|
426515 |
135144574 |
1 |
N2O4C25H32 |
A2B4C25D32 |
-137.43 |
6.32 |
-9.1 |
-0.15 |
0 |
|
|
426516 |
135144575 |
1 |
O3N5C23H35 |
A3B5C23D35 |
-116.95 |
5.03 |
-8.64 |
-0.74 |
0 |
|
|
426517 |
135144576 |
1 |
O5C16H34 |
A5B16C34 |
-298.5 |
3.86 |
-10.76 |
0.6 |
0 |
|
|
426518 |
135144577 |
2 |
NO2C13H20 |
AB2C13D20 |
-197.64 |
3.76 |
-9.07 |
-0.04 |
0 |
|
|
426519 |
135144578 |
2 |
NO3C10H10 |
AB3C10D10 |
-174.13 |
6.3 |
-9.15 |
-1.61 |
0 |
|
|
426520 |
135144579 |
1 |
NO6C17H19 |
AB6C17D19 |
-220.66 |
7.97 |
-9.32 |
-1.46 |
0 |
|
|
426521 |
135144648 |
1 |
ClBr2O2N5C14H18 |
AB2C2D5E14F18 |
1.15 |
9.34 |
-9.16 |
-1.43 |
0 |
|
|
426522 |
135144658 |
1 |
Br2O2N5C15H19 |
A2B2C5D15E19 |
34.11 |
11.13 |
-9.06 |
-1.25 |
0 |
|
|
426523 |
135144661 |
1 |
Br2O2N5C16H19 |
A2B2C5D16E19 |
58.97 |
9.09 |
-9.14 |
-1.32 |
0 |
|
|
426524 |
135144663 |
1 |
Br2O2N5C13H15 |
A2B2C5D13E15 |
59.0 |
11.27 |
-9.15 |
-1.38 |
0 |
|
|
426525 |
135144664 |
1 |
ClBr2O2N5C17H24 |
AB2C2D5E17F24 |
-8.64 |
12.07 |
-8.89 |
-1.21 |
0 |
|
|
426526 |
135144665 |
1 |
ClBr2O3N5C13H16 |
AB2C3D5E13F16 |
-20.83 |
6.32 |
-9.25 |
-1.49 |
0 |
|
|
426527 |
135144771 |
2 |
ON2C9H14 |
AB2C9D14 |
-58.2 |
3.36 |
-8.84 |
0.62 |
0 |
|
|
426528 |
135144909 |
1 |
N4O4C19H32 |
A4B4C19D32 |
-154.3 |
6.15 |
-8.93 |
0.36 |
0 |
|
|
426529 |
135144994 |
1 |
SN5O6C23H25 |
AB5C6D23E25 |
-132.6 |
8.68 |
-9.46 |
-1.55 |
0 |
|
|
426530 |
135145474 |
1 |
SO2N3H21C29 |
AB2C3D21E29 |
64.6 |
6.68 |
-8.76 |
-0.73 |
0 |
|
|
426531 |
135145505 |
1 |
SO4N6H34C36 |
AB4C6D34E36 |
-21.81 |
7.49 |
-8.47 |
-0.97 |
0 |
|
|
426532 |
135145521 |
1 |
FO3N6H21C26 |
AB3C6D21E26 |
-47.11 |
4.84 |
-9.08 |
-1.32 |
0 |
|
|
426533 |
135145591 |
1 |
ClFSO3N4H22C31 |
ABCD3E4F22G31 |
-29.93 |
6.71 |
-9.08 |
-1.17 |
0 |
|
|
426534 |
135145632 |
1 |
ClO4N8C38H41 |
AB4C8D38E41 |
-62.08 |
7.85 |
-8.2 |
-0.69 |
0 |