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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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1413 4362 1 NO2C6H7 AB2C6D7 -59.51 1.08 -10.57 -1.5 0
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1414 4363 1 SN2O4C9H16 AB2C4D9E16 -186.12 4.61 -9.09 0.04 0
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1415 4365 1 SN2O4C15H20 AB2C4D15E20 -161.07 1.22 -8.57 0.01 0
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1416 4376 1 NO4C5H9 AB4C5D9 -176.81 4.69 -9.89 -0.24 0
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1417 4381 1 NO4C7H15 AB4C7D15 -187.8 5.49 -9.29 1.29 0
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1418 4385 1 N3O4C11H21 A3B4C11D21 -221.01 2.83 -9.89 0.38 0
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1419 4386 1 NO2H11C13 AB2C11D13 -34.46 5.52 -8.92 -0.7 0
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1420 4388 1 NO5C7H13 AB5C7D13 -234.6 4.29 -10.5 -0.05 0
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1421 4389 1 NO5C9H13 AB5C9D13 -229.05 6.31 -10.68 -0.44 0
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1422 4391 1 SN2O4C10H16 AB2C4D10E16 -149.7 7.34 -8.9 -0.6 0
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1423 4395 1 O2N3C7H15 A2B3C7D15 -91.89 7.98 -9.44 0.55 0
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1424 4400 1 O4N6C19H22 A4B6C19D22 -86.49 5.79 -9.02 -0.67 0
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1425 4403 1 PN5O7C11H16 AB5C7D11E16 -299.93 4.65 -8.94 -0.58 0
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1426 4404 1 N5O5C18H19 A5B5C18D19 -116.0 5.03 -9.06 -1.23 0
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1427 4406 1 SO4N5C27H31 AB4C5D27E31 -93.54 7.4 -9.52 -1.2 0
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1428 4407 2 ClH2O2C5 AB2C2D5 -118.34 0.5 -9.38 -2.34 0
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1429 4408 1 PO10C12H19 AB10C12D19 -511.13 4.21 -11.14 -0.12 0
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1430 4411 1 NO4C17H27 AB4C17D27 -190.71 4.17 -9.04 0.09 0
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1431 4414 1 SN2O5C21H21 AB2C5D21E21 -130.29 4.98 0.0 0.0 -1
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1432 4415 1 SN2O5C21H22 AB2C5D21E22 -160.01 1.29 -8.78 -0.66 0
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1433 4419 1 NO4C21H27 AB4C21D27 -138.08 5.9 -8.33 0.25 0
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1434 4422 1 NO3C21H25 AB3C21D25 -71.73 3.65 -8.44 0.14 0
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1435 4423 1 NO3C19H21 AB3C19D21 -59.58 3.05 -8.56 0.0 0
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1436 4428 1 NO4C20H23 AB4C20D23 -105.17 5.12 -8.82 -0.25 0
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1437 4430 1 N2O3C26H26 A2B3C26D26 4.31 2.32 -7.72 -0.26 0
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1438 4439 1 O11C42H70 A11B42C70 -586.39 11.64 -9.52 -0.16 0
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1439 4442 1 ON3C17H17 AB3C17D17 24.13 4.96 -8.74 -0.45 0
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1440 4443 1 NO3C19H27 AB3C19D27 -151.05 2.62 -9.64 0.06 0
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1441 4449 1 ClO2N5C25H32 AB2C5D25E32 -20.05 2.7 -8.41 0.0 0
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1442 4450 1 NOC17H19 ABC17D19 11.98 2.33 -8.6 0.08 0
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1443 4454 1 N6O13C23H46 A6B13C23D46 -585.34 5.36 -9.56 0.16 0
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1444 4455 1 O4N5C9H11 A4B5C9D11 -106.32 5.96 -10.03 -1.5 0
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1445 4456 1 N2O2C12H19 A2B2C12D19 -30.6 1.93 0.0 0.0 1
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1446 4462 2 O2C7H9 A2B7C9 -116.53 2.91 -8.65 -1.7 0
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1447 4464 1 N2S3H12O12C17 A2B3C12D12E17 -337.26 5.84 -10.23 -2.54 0
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1448 4466 1 N4S6O21H26C35 A4B6C21D26E35 -708.81 2.99 -9.39 -2.53 0
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1449 4471 1 O2N4C7H17 A2B4C7D17 -73.03 3.96 0.0 0.0 1
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1450 4479 1 P2N7O15C26H36 A2B7C15D26E36 -694.03 9.76 0.0 0.0 1
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1451 4481 1 P2N6O15C21H27 A2B6C15D21E27 -630.01 13.77 0.0 0.0 1
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1452 4482 3 PN2O6C7H9 AB2C6D7E9 -861.49 25.16 -8.95 -2.7 0
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1453 4484 1 NPO9C11H14 ABC9D11E14 -397.31 11.76 -10.34 -2.29 0
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1454 4491 1 O2N3H13C17 A2B3C13D17 30.08 5.78 -8.76 -1.02 0
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1455 4492 1 N4O9C22H28 A4B9C22D28 -350.5 6.65 -9.76 -0.92 0
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1456 4493 1 F3N3O4H10C12 A3B3C4D10E12 -228.32 11.07 -10.26 -1.78 0
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1457 4496 1 N3O3H13C16 A3B3C13D16 27.21 2.36 -9.81 -1.67 0
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1458 4498 1 NO2C6H11 AB2C6D11 -98.54 4.63 -9.58 0.44 0
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1459 4508 1 O6N10H32C41 A6B10C32D41 285.44 9.0 -7.38 -2.25 2
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1460 4509 1 N4O5H6C8 A4B5C6D8 -43.33 5.42 -9.94 -1.85 0
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1461 4511 1 N3H5O5C7 A3B5C5D7 -22.09 4.67 -11.34 -2.39 0
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1462 4518 1 O2C4N5H13 A2B4C5D13 20.14 6.14 -9.13 -0.27 0