List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
246600 103061422 1 BrN6C10H13 AB6C10D13 90.62 1.69 -9.16 -0.88 0
246601 103061428 1 ClN6C8H9 AB6C8D9 101.33 2.26 -9.34 -1.0 0
246602 103061429 1 NO3C11H23 AB3C11D23 -148.23 0.81 -8.85 1.98 0
246603 103061430 1 BrN6C8H9 AB6C8D9 111.5 2.2 -9.4 -1.01 0
246604 103061436 1 O2N5C10H13 A2B5C10D13 -29.58 2.19 -9.21 -0.78 0
246605 103061439 1 NO3C12H23 AB3C12D23 -153.62 1.4 -8.64 2.07 0
246606 103061440 2 N3C5H7 A3B5C7 84.01 4.98 -8.77 -0.77 0
246607 103061441 1 ON6C14H14 AB6C14D14 64.81 3.43 -8.97 -0.94 0
246608 103061442 1 NO2C14H27 AB2C14D27 -121.65 0.99 -8.5 2.05 0
246609 103061468 1 ON6C10H12 AB6C10D12 49.77 6.95 -9.35 -1.07 0
246610 103061469 1 O2N6C11H14 A2B6C11D14 8.28 1.62 -9.09 -0.96 0
246611 103061482 1 ON6C11H14 AB6C11D14 29.7 3.88 -9.31 -0.91 0
246612 103061495 1 NO3C14H27 AB3C14D27 -156.48 2.67 -8.57 2.29 0
246613 103061497 1 NO3C11H21 AB3C11D21 -128.33 2.79 -9.11 2.07 0
246614 103061498 1 O2N7C9H11 A2B7C9D11 101.24 8.27 -9.35 -1.15 0
246615 103061499 1 N2O2C13H24 A2B2C13D24 -81.02 0.38 -8.38 2.17 0
246616 103061501 1 NO3C12H25 AB3C12D25 -166.47 3.01 -8.88 2.11 0
246617 103061502 1 N6C11H16 A6B11C16 82.29 5.65 -9.03 -0.92 0
246618 103061505 1 ON5C14H15 AB5C14D15 43.7 4.22 -8.88 -0.63 0
246619 103061506 1 NO3C13H25 AB3C13D25 -151.24 2.68 -8.56 2.34 0
246620 103061528 1 O2N5C10H11 A2B5C10D11 9.79 2.61 -8.95 -0.66 0
246621 103061529 1 ON5C13H21 AB5C13D21 -7.8 4.35 -8.81 -0.55 0
246622 103061531 1 O2N5C11H15 A2B5C11D15 -36.78 2.63 -9.17 -0.76 0
246623 103061541 1 N7C11H17 A7B11C17 94.06 3.08 -8.96 -0.72 0
246624 103061546 1 ClNO2C15H22 ABC2D15E22 -90.27 2.71 -8.81 0.01 0
246625 103061554 2 NOC8H15 ABC8D15 -116.49 2.64 -8.62 2.29 0
246626 103061557 1 ClO2N6C9H9 AB2C6D9E9 -15.29 4.23 -9.52 -1.2 0
246627 103061563 1 NO2C16H23 AB2C16D23 -78.98 1.97 -8.8 0.5 0
246628 103061566 1 NO2C15H29 AB2C15D29 -132.28 1.66 -8.67 2.28 0
246629 103061721 1 OSN4C10H12 ABC4D10E12 53.54 0.81 -8.84 -0.5 0
246630 103064058 1 S2N3O3C11H15 A2B3C3D11E15 -104.86 3.04 -8.82 -1.42 0
246631 103064061 1 ClSN2O3C12H13 ABC2D3E12F13 -118.11 7.86 -9.01 -1.15 0
246632 103064062 1 SO3N5C10H15 AB3C5D10E15 -76.08 2.02 -8.78 -0.59 0
246633 103064093 1 BrSN2O3C12H13 ABC2D3E12F13 -110.29 2.19 -8.87 -1.32 0
246634 103064100 1 SN2O3C14H24 AB2C3D14E24 -162.05 6.26 -8.82 0.26 0
246635 103064101 1 SN2O3C15H18 AB2C3D15E18 -111.29 7.92 -8.78 -0.51 0
246636 103064105 1 SN2O3C12H20 AB2C3D12E20 -153.43 4.94 -8.69 0.4 0
246637 103064113 1 SN2O3C10H16 AB2C3D10E16 -136.38 7.25 -8.89 0.0 0
246638 103064120 1 SN2O3C11H20 AB2C3D11E20 -161.69 1.4 -8.7 0.41 0
246639 103064141 1 SN2O3C11H20 AB2C3D11E20 -158.72 6.1 -8.91 0.09 0
246640 103064150 1 SN2O3C12H18 AB2C3D12E18 -134.85 3.0 -8.84 0.19 0
246641 103064158 1 SN2O3C11H18 AB2C3D11E18 -143.96 2.28 -8.69 0.4 0
246642 103064245 1 SN2O2C15H16 AB2C2D15E16 -27.35 8.82 -9.2 -1.11 0
246643 103064251 1 N2S2C11H18 A2B2C11D18 -1.49 6.9 -8.15 0.22 0
246644 103064252 2 NOSC5H7 ABCD5E7 -67.53 8.76 -9.0 -0.63 0
246645 103064267 1 ClSN2O2C8H13 ABC2D2E8F13 -116.9 1.87 -8.78 -0.23 0
246646 103064288 1 ClSN3C10H14 ABC3D10E14 14.49 1.96 -8.72 -0.56 0
246647 103064365 1 N2S2O3C9H12 A2B2C3D9E12 -96.52 9.79 -8.44 -1.05 0
246648 103064377 1 SN2O3C11H12 AB2C3D11E12 -94.71 2.18 -8.88 -1.55 0
246649 103064378 1 SN2O3C11H12 AB2C3D11E12 -94.79 2.77 -8.9 -1.61 0