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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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385451 134979118 1 BNOC7H16 ABCD7E16 -92.96 3.28 -8.71 1.44 0
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385452 134979121 1 ZnSi2C16H34 AB2C16D34 70.41 4.28 -6.6 -1.67 0
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385454 134979125 1 NOC11H21 ABC11D21 -66.61 2.74 -8.43 2.86 0
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385455 134979126 1 BrO2C13H25 AB2C13D25 -143.51 1.56 -10.46 -0.03 0
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385456 134979128 2 AlPC5H14 ABC5D14 -108.52 1.51 -8.24 2.27 0
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385457 134979129 1 NO5C11H19 AB5C11D19 -172.23 4.08 -10.37 -0.81 0
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385458 134979136 1 PbC10H20 AB10C20 46.84 0.3 -8.7 0.28 0
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385459 134979146 1 BBrC14H24 ABC14D24 -38.7 2.39 -9.59 -0.28 0
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385460 134979152 1 OC11H18 AB11C18 -30.96 1.62 -9.64 2.0 0
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385461 134979165 1 BC11H25 AB11C25 -66.51 0.26 -9.58 0.73 0
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385462 134979166 1 BC9H15 AB9C15 7.06 0.52 -9.49 0.87 0
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385463 134979167 1 NC8H11 AB8C11 37.66 5.26 -9.76 -0.67 0
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385464 134979168 1 AlLiO2C8H18 ABC2D8E18 -243.04 4.87 -9.43 2.07 0
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385465 134979172 1 OSeC13H18 ABC13D18 -24.88 3.16 -8.08 0.05 0
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385466 134979176 1 NOC8H17 ABC8D17 -54.78 2.45 -9.02 0.88 0
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385467 134979178 1 GeO2C12H24 AB2C12D24 -120.82 1.88 -9.59 0.16 0
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385468 134979180 1 SiO2C14H32 AB2C14D32 -202.02 3.09 -8.93 1.45 0
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385469 134979181 1 ClSiC13H19 ABC13D19 -22.05 2.21 -9.46 0.21 0
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385470 134979182 1 OSiC13H22 ABC13D22 -81.84 1.59 -8.62 0.61 0
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385471 134979185 1 SSnC9H12 ABC9D12 83.82 0.8 -9.02 -0.34 0
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385472 134979186 1 NPbC15H29 ABC15D29 30.32 3.5 -9.15 -0.13 0
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385473 134979187 1 BrPbC10H19 ABC10D19 42.5 1.98 -9.07 0.29 0
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385474 134979189 2 OC6H12 AB6C12 -124.8 3.36 -9.27 2.12 0
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385475 134979190 1 BN3C4H4 AB3C4D4 134.12 7.15 -7.98 -1.44 -1
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385476 134979191 1 BH3N3C4 AB3C3D4 104.93 5.17 0.0 0.0 0
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385477 134979193 1 BSO2H11C14 ABC2D11E14 -63.36 2.11 -8.69 -0.43 0
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385478 134979195 1 BN3H4C7 AB3C4D7 130.54 0.93 -8.04 -1.74 0
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385479 134979196 2 BCO2H3 ABC2D3 -286.34 4.44 -10.74 -0.06 0
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385480 134979197 1 SO2C13H24 AB2C13D24 -139.57 1.33 -9.09 0.21 0
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385482 134979202 1 BO2C9H15 AB2C9D15 -133.87 2.69 -9.1 1.26 0
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385483 134979207 1 BOSiC11H23 ABCD11E23 -123.88 1.08 -9.32 1.2 0
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385484 134979208 1 BLiC10H18 ABC10D18 -45.46 3.49 -7.85 0.44 0
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385485 134979210 1 OC12H24 AB12C24 -95.14 3.05 -9.56 0.79 0
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385486 134979212 11 CH2 AB2 -36.73 0.26 -9.42 1.47 0
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385487 134979215 1 SiO2C16H32 AB2C16D32 -145.65 3.74 -9.91 0.89 0
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385488 134979216 1 O2C11H24 A2B11C24 -141.04 2.77 -9.78 2.12 0
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385489 134979218 1 SiO2C13H27 AB2C13D27 -154.13 2.07 0.0 0.0 0
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385490 134979222 1 GeNO2C14H19 ABC2D14E19 12.49 5.05 -8.68 -0.48 0
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385491 134979226 1 ClGeC16H33 ABC16D33 -111.12 3.35 -9.57 0.01 0
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385492 134979227 1 OSiC14H24 ABC14D24 -85.17 1.83 -9.04 0.26 0
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385493 134979237 1 BPCl3C13H28 ABC3D13E28 -103.92 9.71 0.0 0.0 0
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385494 134979239 1 BOC11H21 ABC11D21 -100.53 1.48 -9.08 1.03 0
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385495 134979240 2 C7H11 A7B11 13.65 0.63 -9.47 0.62 0
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385496 134979241 1 OC17H32 AB17C32 -100.37 3.52 -9.42 0.59 0
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385497 134979245 1 BBrC12H18 ABC12D18 10.5 1.44 -9.56 -0.66 0
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385499 134979249 1 BSiCl2C11H25 ABC2D11E25 -154.91 2.16 -9.46 0.04 0
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385500 134979250 1 IOC14H23 ABC14D23 -39.04 2.82 -9.17 -0.83 0
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385501 134979251 2 C7H13 A7B13 -48.5 0.59 -9.09 1.59 0
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385502 134979252 1 SiO2C14H20 AB2C14D20 -116.16 2.89 -9.6 0.17 0
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385503 134979255 1 BC15H33 AB15C33 -88.76 0.18 -9.47 0.8 0
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385504 134979256 1 BrClC12H24 ABC12D24 -70.8 4.35 -10.45 -0.03 0
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385505 134979259 1 O3C14H20 A3B14C20 -116.14 5.97 -9.17 -0.56 0
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385506 134979263 2 OC5H10 AB5C10 -111.37 1.25 -9.52 2.2 0
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385507 134979266 1 SiN2H8C9 AB2C8D9 48.88 5.16 -10.0 -0.69 0
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385508 134979269 1 BrGeCl2C7H13 ABC2D7E13 -91.72 3.42 -10.05 -1.57 0
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385509 134979270 1 GeIC10H13 ABC10D13 20.85 3.05 -9.12 -1.22 0
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385510 134979272 1 OSiC10H20 ABC10D20 -75.6 2.28 -9.27 0.59 0
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385511 134979273 1 SiO2C12H26 AB2C12D26 -162.46 1.89 -9.52 0.83 0
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385512 134979275 1 NaSSiSnO4C9H21 ABCDE4F9G21 -174.81 16.39 -8.7 -0.37 0
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385513 134979277 1 NPbC9H17 ABC9D17 61.6 3.6 -9.11 -0.12 0
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385514 134979278 1 PbO4C11H20 AB4C11D20 -146.78 0.93 -9.71 -0.51 0
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385515 134979281 1 BN3C9H13 AB3C9D13 39.23 10.84 0.0 0.0 0
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385516 134979286 1 BO2C16H33 AB2C16D33 -198.24 2.82 -9.58 1.38 0
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385517 134979288 1 SiO2C13H26 AB2C13D26 -151.45 1.47 -9.62 1.5 0
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385518 134979289 2 OC6H12 AB6C12 -144.52 1.76 -10.14 2.71 0
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385519 134979297 4 C4H7 A4B7 -30.44 0.12 -9.41 1.25 -2
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385520 134979298 1 AuPO2C22H25 ABC2D22E25 99.0 5.69 0.0 0.0 0
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385521 134979299 12 CH AB 166.26 0.54 -9.22 0.64 0
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385522 134979302 2 H9C13 A9B13 128.88 0.41 -8.64 -0.51 0
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385523 134979304 1 IC12H15 AB12C15 28.6 1.86 -9.35 -0.6 0
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385524 134979305 1 PO2C23H31 AB2C23D31 -99.9 6.1 -9.42 -0.19 0
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385525 134979310 2 H11C12 A11B12 141.4 0.35 -9.1 0.31 0
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385526 134979313 1 F3O3C15H17 A3B3C15D17 -291.44 3.79 -9.63 -0.36 0
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385527 134979314 18 CH AB 52.7 0.77 -8.72 -0.32 0
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385528 134979315 4 H5C6 A5B6 106.76 0.23 -8.91 -0.12 0