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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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387333 134984970 1 NOPC25H34 ABCD25E34 -73.79 3.87 -9.34 -0.12 0
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387334 134984971 1 NSO3C20H23 ABC3D20E23 -80.58 5.33 -9.54 -0.37 0
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387335 134984972 1 ClSN2O4C19H19 ABC2D4E19F19 -93.25 5.34 -9.92 -0.56 0
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387336 134984978 1 FSN2O3C19H25 ABC2D3E19F25 -162.61 8.05 -9.74 -0.33 0
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387337 134984984 1 FNSCl3O4C13H15 ABCD3E4F13G15 -208.5 3.84 -10.14 -1.14 0
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387338 134984987 1 N2O2H22C23 A2B2C22D23 27.1 3.4 -9.09 -0.44 0
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387339 134984991 2 NSO2C11H16 ABC2D11E16 -128.36 1.45 -9.12 -0.66 0
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387340 134984998 1 NO6C24H35 AB6C24D35 -184.1 2.82 -8.63 -0.33 0
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387341 134985014 1 N2O5C18H26 A2B5C18D26 -83.37 5.1 -10.04 -0.85 0
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387342 134985015 1 PN3O5C22H22 AB3C5D22E22 -29.98 7.68 -10.06 -1.41 0
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387343 134985016 1 SN2O5C15H20 AB2C5D15E20 -117.01 3.72 -8.79 -1.06 0
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387344 134985018 2 BrNOH10C11 ABCD10E11 72.74 0.54 -8.45 -1.04 0
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387345 134985021 1 SN2O7C17H22 AB2C7D17E22 -195.84 5.91 -8.75 -1.04 0
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387346 134985029 2 NO2C4H8 AB2C4D8 -40.4 5.27 -11.23 -1.32 0
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387347 134985032 1 NH3O3F10C14 AB3C3D10E14 -436.07 3.93 -10.7 -1.81 0
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387348 134985033 1 NOC19H23 ABC19D23 39.81 0.24 -9.31 0.14 0
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387349 134985036 1 PC14H23 AB14C23 -5.85 1.5 -8.95 0.4 0
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387351 134985045 1 NPO3C19H30 ABC3D19E30 -193.74 2.44 -9.1 0.37 0
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387352 134985047 2 NO2C7H15 AB2C7D15 -198.64 3.28 -9.15 1.62 0
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387353 134985050 1 FN3O3C14H18 AB3C3D14E18 -119.66 2.97 -9.23 -1.15 0
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387354 134985060 1 N5O7C9H9 A5B7C9D9 -23.14 9.3 -10.24 -2.23 0
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387355 134985064 1 SSnN2O2Cl4H18C22 ABC2D2E4F18G22 7.13 11.29 -8.47 -1.94 1
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387356 134985065 1 N2H11C15 A2B11C15 117.82 2.66 0.0 0.0 0
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387357 134985066 1 N8H10O13C15 A8B10C13D15 34.92 1.65 -11.52 -3.0 1
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387358 134985070 1 N2O2H13C16 A2B2C13D16 52.67 3.75 0.0 0.0 0
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387359 134985071 1 FSO3H15C20 ABC3D15E20 -76.71 2.66 -9.42 -0.96 0
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387360 134985074 1 N5O8C11H13 A5B8C11D13 10.18 6.56 -11.16 -2.91 0
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387361 134985075 2 O2N3C5H7 A2B3C5D7 44.33 6.88 -9.59 -0.93 0
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387362 134985085 2 NOC5H7 ABC5D7 17.32 0.66 -9.85 -0.74 0
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387363 134985088 1 NSC6O6F13 ABC6D6E13 -865.04 2.14 -11.7 -1.99 0
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387364 134985093 1 ClSN2O2C16H21 ABC2D2E16F21 -70.74 5.34 -8.6 -0.42 0
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387365 134985095 1 NSO2C21H23 ABC2D21E23 -17.78 5.29 -9.09 -0.44 0
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387366 134985107 1 SN2O2C14H20 AB2C2D14E20 -24.25 4.01 -9.3 -0.02 0
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387367 134985111 1 NSO4C14H17 ABC4D14E17 -72.89 5.89 -9.24 -0.83 0
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387368 134985112 1 SiN2O4C17H32 AB2C4D17E32 -179.5 5.55 -9.14 -0.49 0
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387369 134985118 1 ClNOC10H18 ABCD10E18 -33.22 2.95 -9.31 -0.96 0
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387370 134985119 1 NO3C11H13 AB3C11D13 -58.67 0.84 -9.25 -0.86 0
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387371 134985121 1 NO6C23H23 AB6C23D23 -127.41 6.74 -9.21 -1.2 0
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387372 134985123 2 ClNOH6C7 ABCD6E7 60.37 3.43 -9.12 -1.43 0
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387373 134985127 1 ClNPSO2C5H11 ABCDE2F5G11 -131.19 5.22 -9.49 -0.48 0
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387374 134985135 1 NO5C13H23 AB5C13D23 -177.14 2.84 -10.46 -0.55 0
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387375 134985139 1 N2O2H16C21 A2B2C16D21 111.17 4.86 -9.7 -0.99 0
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387376 134985140 1 N2O8C21H32 A2B8C21D32 -289.72 4.6 -9.94 -0.34 0
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387377 134985148 1 NO2C9H17 AB2C9D17 -32.85 4.87 -10.25 -0.51 0
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387378 134985158 1 NO7C20H29 AB7C20D29 -284.24 1.23 -9.66 -0.51 0
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387379 134985162 1 BrClC2F2N2 ABC2D2E2 -41.43 2.03 -10.91 -3.09 0
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387380 134985163 1 PC17H29 AB17C29 -24.45 1.56 -8.72 0.61 0
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387381 134985166 1 AlFeNPO2Cl4C18H32 ABCDE2F4G18H32 -304.75 11.58 0.0 0.0 0
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387384 134985186 2 ClN3C9H9 AB3C9D9 102.06 5.89 -8.66 -1.21 0
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387385 134985187 2 ClN3H11C12 AB3C11D12 133.26 8.75 -8.6 -1.06 0