List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
259525 103167349 1 NO3C12H15 AB3C12D15 -79.11 5.28 -10.07 -0.99 0
259526 103167358 1 O3N4C11H18 A3B4C11D18 -61.18 5.36 -9.83 -0.78 0
259527 103167359 1 O2N4C9H14 A2B4C9D14 -15.95 3.69 -11.17 -0.76 0
259528 103167374 1 O2N4C11H18 A2B4C11D18 -29.04 5.96 -10.66 -0.08 0
259529 103167381 1 O2N4C11H18 A2B4C11D18 -29.61 2.7 -10.92 -0.38 0
259530 103167488 1 N2O3C14H22 A2B3C14D22 -111.9 1.7 -9.82 -0.33 0
259531 103167491 1 ClNSC14H16 ABCD14E16 20.55 2.12 -9.1 -0.68 0
259532 103167505 1 BrNOC14H16 ABCD14E16 -1.0 1.82 -9.4 -0.51 0
259533 103167522 1 NCl2C12H15 AB2C12D15 -5.01 3.27 -9.9 -0.54 0
259534 103167534 2 NOC7H12 ABC7D12 -67.89 2.97 -9.21 0.37 0
259535 103167585 1 ON3C12H21 AB3C12D21 -16.92 8.23 -9.63 0.49 0
259536 103167599 1 ClN3C14H16 AB3C14D16 60.42 6.31 -9.82 -0.62 0
259537 103167681 1 SO2N4C9H16 AB2C4D9E16 -38.43 4.46 -10.35 -0.34 0
259538 103167682 1 SO2N4C10H18 AB2C4D10E18 -44.2 4.89 -10.35 -0.39 0
259539 103167684 1 SO2N4C7H12 AB2C4D7E12 -27.9 7.01 -10.48 -0.35 0
259540 103167698 1 ClO2N3C12H16 AB2C3D12E16 -48.16 5.37 -9.5 -0.97 0
259541 103167706 1 BrON2C7H9 ABC2D7E9 9.91 4.22 -10.35 -1.25 0
259542 103167716 1 O2C13H22 A2B13C22 -105.18 4.22 -9.69 0.7 0
259543 103167732 2 OC8H15 AB8C15 -128.74 2.99 -9.56 0.76 0
259544 103167733 1 ON2C12H18 AB2C12D18 -11.08 6.39 -9.87 -0.09 0
259545 103167745 1 BrO3C16H21 AB3C16D21 -105.79 6.75 -8.98 -0.33 0
259546 103167812 2 OC8H11 AB8C11 -78.95 3.69 -9.33 -0.17 0
259547 103167816 2 OC9H10 AB9C10 -44.54 4.74 -9.19 -0.94 0
259548 103167821 1 FO2C15H19 AB2C15D19 -117.96 3.92 -9.68 -0.53 0
259549 103167825 1 O3C17H24 A3B17C24 -116.33 2.88 -9.18 -0.36 0
259550 103167833 1 O3C12H16 A3B12C16 -94.39 4.56 -9.68 -0.3 0
259551 103167886 1 ON2C13H20 AB2C13D20 -21.13 5.48 -9.3 0.61 0
259552 103167911 1 ClN2O2C14H21 AB2C2D14E21 -70.24 2.07 -9.19 0.14 0
259553 103167959 1 NOC15H19 ABC15D19 -24.95 2.58 -9.44 -0.16 0
259554 103167962 1 N2O2C17H22 A2B2C17D22 -45.74 0.38 -8.95 -0.24 0
259555 103167993 1 NSO2C16H25 ABC2D16E25 -82.12 3.86 -9.28 -0.49 0
259556 103168004 1 SO3C17H28 AB3C17D28 -151.33 6.0 -8.33 0.37 0
259557 103168044 2 OC7H13 AB7C13 -119.48 4.66 -9.63 0.76 0
259558 103168074 1 O4C17H24 A4B17C24 -146.3 5.99 -9.24 -0.33 0
259559 103168084 1 O2C13H20 A2B13C20 -66.48 4.41 -9.77 0.63 0
259560 103168087 1 ON3C11H17 AB3C11D17 5.31 3.18 -10.49 -0.84 0
259561 103168121 1 FO3C16H17 AB3C16D17 -121.07 3.91 -9.71 -1.24 0
259562 103168167 1 ClFOC12H12 ABCD12E12 -70.43 2.83 -9.78 -0.92 0
259563 103168211 1 NOC12H25 ABC12D25 -70.5 2.54 -8.84 2.51 0
259564 103168230 1 BrNOC16H24 ABCD16E24 -33.42 1.49 -8.92 -0.16 0
259565 103168260 1 NOC18H29 ABC18D29 -56.17 1.33 -8.84 0.54 0
259566 103168278 1 NOC17H35 ABC17D35 -94.1 1.24 -8.85 2.38 0
259567 103168313 1 NOC13H25 ABC13D25 -50.16 1.68 -8.78 1.29 0
259568 103168363 1 ON3C15H27 AB3C15D27 -24.21 4.27 -8.77 0.74 0
259569 103168437 1 NOCl2C17H25 ABC2D17E25 -60.28 1.7 -8.99 -0.49 0
259570 103168465 1 NC18H29 AB18C29 -13.64 1.79 -8.72 0.5 0
259571 103168469 1 NC20H33 AB20C33 -23.78 1.69 -8.76 0.47 0
259572 103168476 1 BrFNC16H23 ABCD16E23 -41.67 3.42 -9.09 -0.27 0
259573 103168492 1 NOC18H29 ABC18D29 -55.6 1.49 -9.05 0.36 0
259574 103168505 1 ClNO2C16H24 ABC2D16E24 -86.02 2.92 -8.88 -0.2 0
259575 103168510 1 NOC17H35 ABC17D35 -96.82 2.23 -8.78 2.51 0
259576 103168531 1 NO2C16H31 AB2C16D31 -119.68 2.5 -8.82 2.2 0
259577 103168537 1 BrNSC12H18 ABCD12E18 21.55 2.33 -9.03 -0.47 0
259578 103168552 1 NOC17H27 ABC17D27 -45.72 0.81 -9.36 0.37 0
259579 103168613 1 NOC15H31 ABC15D31 -88.89 3.13 -8.69 2.49 0
259580 103168619 1 ON2C14H22 AB2C14D22 -30.25 1.69 -9.46 -0.13 0
259581 103168625 1 NO2C13H21 AB2C13D21 -58.95 3.14 -9.07 0.65 0
259582 103168637 1 NO2C12H23 AB2C12D23 -103.42 1.75 -9.39 2.12 0
259583 103168657 1 N3C11H19 A3B11C19 26.0 3.58 -9.41 0.81 0
259584 103168678 1 NOF2C17H25 ABC2D17E25 -130.24 2.74 -9.02 -0.37 0
259585 103168691 1 ON3C15H27 AB3C15D27 -31.31 3.15 -8.98 0.92 0
259586 103168744 1 INC15H22 ABC15D22 21.07 1.22 -8.92 -0.82 0
259587 103168750 1 NOC18H27 ABC18D27 -38.22 3.06 -8.34 0.41 0
259588 103168783 1 NC10H19 AB10C19 -3.75 2.16 -9.4 1.28 0
259589 103168790 1 NOC18H35 ABC18D35 -89.42 2.59 -8.65 2.54 0
259590 103168791 1 NOC15H29 ABC15D29 -82.29 1.51 -9.13 2.35 0
259591 103168826 1 NC15H23 AB15C23 -9.65 1.91 -8.65 0.58 0
259592 103168841 1 ON3C17H31 AB3C17D31 -40.25 4.08 -9.05 0.93 0
259593 103168844 3 NC6H11 AB6C11 -4.98 3.72 -8.59 0.89 0
259594 103168860 1 NOC13H25 ABC13D25 -74.43 1.89 -9.32 2.34 0
259595 103168862 1 NO2C17H33 AB2C17D33 -125.26 2.19 -8.68 2.3 0
259596 103168867 1 NO2C16H31 AB2C16D31 -122.88 1.44 -8.8 2.36 0
259597 103168892 1 NOC11H19 ABC11D19 -6.78 3.43 -9.16 1.71 0
259598 103168931 1 BrN3C16H28 AB3C16D28 6.13 3.74 -8.99 0.26 0
259599 103168962 1 ON4C16H30 AB4C16D30 -28.88 5.2 -9.26 0.6 0