List Systems

Back
Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
82436 49856028 2 O3C24H46 A3B24C46 -466.2 2.26 -10.34 0.57 0
82437 49856029 2 O3C22H42 A3B22C42 -448.79 4.51 -10.62 0.49 0
82438 49856030 2 O3C24H44 A3B24C44 -418.68 3.87 -9.55 0.6 0
82439 49856031 6 OC8H14 AB8C14 -320.56 1.17 -7.15 0.31 0
82440 49856032 1 O6N9H45C47 A6B9C45D47 -69.09 8.01 -8.58 -0.6 0
82441 49856034 1 O5N8C40H40 A5B8C40D40 -60.43 8.91 -8.72 -0.7 0
82442 49856035 1 SN2O4H18C20 AB2C4D18E20 -99.02 6.9 -8.84 -0.86 0
82443 49856037 1 O4N5C22H27 A4B5C22D27 -80.29 2.73 -8.91 -1.16 0
82444 49856038 1 O4N5C22H27 A4B5C22D27 -79.7 4.84 -8.92 -1.11 0
82445 49856040 3 ON2C8H10 AB2C8D10 -57.9 8.32 -8.83 -0.9 0
82451 49856046 1 ClNNaOC12H17 ABCDE12F17 -63.64 7.21 -8.1 0.71 0
82452 49856048 1 O15C25H26 A15B25C26 -573.55 6.3 -9.28 -1.39 0
82453 49856049 1 O15C25H26 A15B25C26 -566.52 7.47 -9.23 -1.32 0
82454 49856050 1 O4C27H44 A4B27C44 -220.44 2.66 -9.44 0.56 0
82455 49856051 1 PO3N5C32H34 AB3C5D32E34 -35.62 8.82 -8.54 -0.97 0
82456 49856053 1 BrFPO3N4H29C31 ABCD3E4F29G31 -68.53 5.59 -8.64 -1.12 0
82457 49856054 1 ClPO4N5H29C30 ABC4D5E29F30 -28.15 5.19 -8.6 -1.16 0
82458 49856055 1 O6C23H32 A6B23C32 -277.56 5.97 -8.54 0.19 0
82459 49856058 2 O3C8H11 A3B8C11 -259.13 6.41 -8.64 0.03 0
82460 49856059 1 O6C17H24 A6B17C24 -270.42 3.14 -8.63 0.01 0
82461 49856060 3 O2C5H6 A2B5C6 -238.16 2.71 -9.07 -0.47 0
82462 49856061 1 O2N4C21H22 A2B4C21D22 2.62 1.78 -9.0 -0.13 0
82463 49856062 1 OSN5C17H19 ABC5D17E19 42.82 4.61 -8.84 -1.38 0
82464 49856063 1 OSN5C19H23 ABC5D19E23 30.38 6.64 -9.06 -1.28 0
82465 49856064 1 OSN5C21H27 ABC5D21E27 14.78 4.67 -9.13 -1.34 0
82466 49856065 1 OSN5C17H19 ABC5D17E19 48.92 4.59 -8.85 -1.32 0
82467 49856068 1 ON5C17H21 AB5C17D21 -5.4 7.08 -9.57 -1.16 0
82468 49856070 1 ON5H21C22 AB5C21D22 79.51 5.4 -8.67 -0.66 0
82469 49856071 1 ClN5H20C22 AB5C20D22 109.86 5.88 -9.36 -0.65 0
82470 49856072 1 ON4C24H24 AB4C24D24 67.25 6.04 -8.7 -0.38 0
82471 49856073 1 N5H23C25 A5B23C25 161.76 2.54 -9.07 -0.42 0
82472 49856074 1 ClO2N3C19H20 AB2C3D19E20 -13.11 3.05 -8.89 -0.3 0
82473 49856075 2 SN2O4H12C15 AB2C4D12E15 -104.47 17.65 -9.5 -1.74 0
82474 49856076 1 S2N3O5C26H27 A2B3C5D26E27 -106.9 7.72 -9.31 -1.52 0
82475 49856079 1 S2F3N3O7H22C30 A2B3C3D7E22F30 -235.99 14.48 -9.63 -1.84 0
82476 49856080 1 OSF3N4C27H29 ABC3D4E27F29 -148.34 3.21 -9.04 -1.07 0
82477 49856081 1 O5C21H22 A5B21C22 -157.32 5.23 -8.81 -0.86 0
82478 49856082 1 NI3O4H14C16 AB3C4D14E16 -63.44 3.06 -8.92 -1.4 0
82479 49856083 1 N3O4C25H33 A3B4C25D33 -108.71 2.98 -8.63 -0.43 0
82480 49856084 1 N3O4C22H33 A3B4C22D33 -153.15 5.89 -8.7 -0.46 0
82481 49856085 1 N3O4C25H37 A3B4C25D37 -155.34 2.21 -8.66 -0.38 0
82482 49856086 1 O3N4C26H36 A3B4C26D36 -80.93 2.75 -8.67 -0.39 0
82483 49856087 1 N3O3C20H29 A3B3C20D29 -107.48 6.9 -8.88 -0.42 0
82484 49856088 1 FN2O2C24H29 AB2C2D24E29 -85.29 4.85 -8.65 -0.4 0
82485 49856089 1 ClO2N7H18C23 AB2C7D18E23 97.77 5.41 -8.34 -1.3 0
82486 49856090 1 ClO3N7C22H24 AB3C7D22E24 -11.47 3.4 -8.31 -1.23 0
82487 49856091 1 ClFO3N8H18C21 ABC3D8E18F21 -0.46 2.28 -8.35 -1.47 0
82488 49856092 1 ClO4N7C23H24 AB4C7D23E24 -46.77 10.42 -8.43 -1.63 0
82489 49856093 1 ClO2N7H10C15 AB2C7D10E15 66.38 8.8 -8.85 -1.69 0
82490 49856095 1 O3N5H27C29 A3B5C27D29 17.37 7.09 -9.28 -1.42 0
82491 49856096 1 O3N5H27C29 A3B5C27D29 25.83 6.25 -9.31 -1.34 0
82492 49856097 1 O3N5H29C30 A3B5C29D30 17.13 5.64 -9.13 -1.16 0
82493 49856098 1 O4N5H25C28 A4B5C25D28 -13.06 7.48 -9.37 -1.38 0
82494 49856099 1 BrN3O3H22C25 AB3C3D22E25 -16.51 4.19 -9.35 -1.35 0
82495 49856100 1 SO3N5H25C32 AB3C5D25E32 40.33 8.39 -9.04 -1.72 0
82496 49856103 1 SN3O3H27C34 AB3C3D27E34 16.67 6.94 -8.84 -1.01 0
82497 49856104 1 SN3O5H25C31 AB3C5D25E31 -65.86 9.38 -9.09 -1.11 0
82498 49856105 1 N11O19C51H83 A11B19C51D83 -889.39 13.5 -9.4 -0.57 0
82499 49856106 1 NO2C11H15 AB2C11D15 -67.57 7.2 -8.63 -0.75 0
82500 49856107 1 CuO4H6C8 AB4C6D8 -78.5 4.44 0.0 0.0 0
82501 49856108 2 N2O3C10H16 A2B3C10D16 -227.13 2.88 -9.68 -0.02 0
82502 49856109 1 O2P2C73H100 A2B2C73D100 -147.46 2.12 -8.03 0.33 0
82503 49856110 1 NO8C43H49 AB8C43D49 -228.69 4.8 -8.46 -0.53 0
82504 49856111 1 NO6C38H41 AB6C38D41 -144.12 2.24 -7.76 -0.83 0
82505 49856112 1 BrNSiO7C43H60 ABCD7E43F60 -260.68 1.96 -7.54 -0.81 0
82506 49856113 1 OC7H8 AB7C8 24.72 4.69 -9.7 -0.55 0
82508 49856116 2 ClNO2C19H19 ABC2D19E19 -83.76 2.85 -8.5 -0.6 0
82509 49856117 1 Cl2N3O3C50H53 A2B3C3D50E53 -3.36 5.65 -8.75 -0.52 0
82510 49856118 1 O4C17H30 A4B17C30 -230.68 3.65 -9.9 0.6 0
82511 49856120 2 OC6H10 AB6C10 -118.02 1.92 -9.1 0.95 0
82512 49856121 2 OC5H9 AB5C9 -94.7 3.9 -10.05 2.17 0
82513 49856122 2 OC5H9 AB5C9 -109.12 1.2 -10.02 0.9 0
82514 49856123 3 OC4H6 AB4C6 -141.85 3.33 -9.92 0.11 0
82515 49856124 6 OC4H6 AB4C6 -309.84 4.38 -8.68 0.35 0
82516 49856125 1 OSi2C14H30 AB2C14D30 -125.49 1.8 -9.07 0.59 0
82517 49856126 1 SO4N5C32H39 AB4C5D32E39 -73.86 7.69 -8.99 -0.82 0
82518 49856129 1 O2N5C23H37 A2B5C23D37 -68.65 5.9 -8.31 -0.07 0
82519 49856130 1 O2N5C20H31 A2B5C20D31 -59.03 7.26 -8.21 0.04 0
82520 49856131 1 O2N5C26H35 A2B5C26D35 -30.52 3.91 -8.21 0.02 0
82521 49856132 1 O4N6C31H32 A4B6C31D32 -54.49 6.78 -8.64 -0.8 0
82522 49856133 1 N5O5C32H33 A5B5C32D33 -109.98 6.73 -8.53 -0.93 0
82523 49856135 1 O5N6C32H34 A5B6C32D34 -97.44 4.92 -8.73 -0.79 0
82524 49856136 1 ClFSO2N3H17C26 ABCD2E3F17G26 18.28 1.71 -8.69 -1.57 0
82525 49856137 1 ClFO2N3H19C28 ABC2D3E19F28 15.29 6.16 -8.59 -1.09 0
82526 49856138 1 ClFO2N3H19C28 ABC2D3E19F28 14.63 2.6 -8.76 -1.25 0
82527 49856139 1 ClFN3O4H27C32 ABC3D4E27F32 -88.54 5.52 -8.66 -1.38 0
82528 49856140 1 ClFSN3O3H27C32 ABCD3E3F27G32 -53.13 3.09 -8.67 -1.46 0
82529 49856141 1 N2O6C25H26 A2B6C25D26 -151.31 6.5 -8.29 -0.29 0
82530 49856142 1 N3O5C25H27 A3B5C25D27 -108.08 5.22 -8.27 -0.04 0
82531 49856146 1 NO4C17H19 AB4C17D19 -83.3 3.78 -8.42 -0.52 0
82532 49856147 1 BFNO2Si2C24H41 ABCD2E2F24G41 -265.27 1.82 -8.44 0.14 0
82533 49856148 1 BNO2Si2C25H44 ABC2D2E25F44 -224.26 2.09 -8.36 0.59 0
82534 49856149 1 BNO2Si2C25H44 ABC2D2E25F44 -243.68 1.7 -8.45 0.61 0
82535 49856150 1 BNO2Si2C24H48 ABC2D2E24F48 -281.19 2.26 -8.41 1.48 0
82536 49856151 1 BClFNO2C18H26 ABCDE2F18G26 -225.7 6.3 -8.98 0.2 0
82537 49856152 1 BFNO2C18H25 ABCD2E18F25 -185.71 4.7 -8.92 0.27 0
82538 49856153 1 BClFNO2C18H26 ABCDE2F18G26 -195.74 6.67 -9.26 0.22 0
82539 49856154 1 BFNO2C18H25 ABCD2E18F25 -188.65 5.34 -9.12 0.3 0
82540 49856155 1 BClN3O4C30H39 ABC3D4E30F39 -219.57 10.8 -9.64 -0.39 0
82541 49856157 1 BN3O5C31H42 AB3C5D31E42 -249.74 9.93 -9.14 -0.16 0