List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
4516 11534 1 BrNC2H2 ABC2D2 29.42 3.18 -11.24 -1.2 0
4517 11535 2 C2H3 A2B3 30.47 0.47 -9.71 1.17 0
4518 11538 1 CKNO ABCD -46.86 12.91 -8.23 -0.03 0
4519 11541 1 NOC7H16 ABC7D16 -17.82 2.68 0.0 0.0 1
4520 11542 1 C7H16 A7B16 -43.12 0.05 -10.92 4.18 0
4521 11543 1 OC6H14 AB6C14 -83.46 1.94 -10.33 3.0 0
4522 11548 1 ClN2O2C7H17 AB2C2D7E17 -126.47 7.41 -8.7 0.52 0
4523 11550 1 OC7H14 AB7C14 -80.88 2.04 -10.23 2.88 0
4524 11553 1 BrO2C3H5 AB2C3D5 -93.75 3.26 -10.96 -0.6 0
4525 11555 1 SC4O6N8H14 AB4C6D8E14 -262.2 7.74 -9.88 -0.43 0
4526 11556 1 OSN2C3H6 ABC2D3E6 -36.59 1.94 -9.83 -0.74 0
4527 11557 1 NC2H3O4 AB2C3D4 -76.92 3.16 -11.8 -1.56 0
4528 11558 1 O2C5H6 A2B5C6 -67.9 5.25 -11.0 -0.63 0
4529 11562 1 BrNC6H6 ABC6D6 22.49 3.05 -8.81 -0.05 0
4530 11566 1 OC7H14 AB7C14 -78.82 2.25 -10.2 2.84 0
4531 11567 1 OC7H12 AB7C12 -65.66 3.61 -9.86 0.82 0
4532 11569 2 OC4H4 AB4C4 -43.25 1.61 -9.16 -0.79 0
4533 11570 1 NO2C10H13 AB2C10D13 -77.29 3.36 -8.71 0.12 0
4534 11572 1 C7H12 A7B12 -9.43 0.35 -9.37 1.55 0
4535 11573 1 C7H12 A7B12 -9.39 0.37 -9.46 1.49 0
4536 11574 1 C7H12 A7B12 -8.17 0.55 -8.98 1.72 0
4537 11576 1 O3C8H14 A3B8C14 -155.04 2.8 -10.61 0.24 0
4538 11577 1 NO2C7H15 AB2C7D15 -118.52 2.37 -9.97 0.8 0
4539 11578 1 CaO6C10H14 AB6C10D14 -390.44 1.87 -10.19 0.64 0
4540 11579 1 O3C5H8 A3B5C8 -143.37 6.65 -10.85 -0.18 0