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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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395237 135024991 1 N3O8C11H15 A3B8C11D15 -332.69 4.87 -10.3 -0.94 0
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395238 135024997 1 N5O5C33H35 A5B5C33D35 -144.76 10.26 -8.55 -0.53 0
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395239 135024999 1 NO2H15C17 AB2C15D17 -10.77 3.73 -8.96 -0.35 0
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395240 135025000 1 NO2H13C17 AB2C13D17 33.76 4.39 -9.06 -0.5 0
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395241 135025001 1 BrNO2H16C18 ABC2D16E18 -15.79 3.19 -9.1 -0.74 0
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395242 135025007 1 FO6C16H19 AB6C16D19 -277.31 4.22 -9.67 -0.96 0
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395243 135025008 1 FN2O6C19H19 AB2C6D19E19 -245.79 10.64 -9.66 -1.26 0
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395244 135025010 1 SO3C18H18 AB3C18D18 -70.97 5.24 -9.62 -0.59 0
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395246 135025015 1 NO6C17H18 AB6C17D18 -175.61 2.67 0.0 0.0 0
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395247 135025017 1 ClO2F3H22C24 AB2C3D22E24 -203.64 1.31 -9.37 -0.61 0
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395248 135025018 1 NH15C16 AB15C16 73.03 1.79 -8.22 0.29 0
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395250 135025020 2 OC5H9 AB5C9 -106.25 2.72 -8.83 1.34 -1
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395251 135025022 1 NOSiC5H12 ABCD5E12 -58.76 4.21 0.0 0.0 0
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395252 135025023 1 N3O3H31C35 A3B3C31D35 63.01 5.46 -8.7 -0.46 -1
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395253 135025027 1 NPO2H19C21 ABC2D19E21 31.99 2.96 0.0 0.0 0
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395254 135025029 1 N2S2O3C21H26 A2B2C3D21E26 -86.05 8.38 -9.16 -0.48 0
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395255 135025030 1 O5C27H36 A5B27C36 -153.98 7.25 -9.55 -0.98 0
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395256 135025031 1 NOSiC18H41 ABCD18E41 -156.35 0.92 -8.51 1.2 0
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395257 135025032 1 NC23H33 AB23C33 8.87 0.92 -8.41 0.41 0
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395258 135025033 1 ClINSO4H19C23 ABCDE4F19G23 -50.27 5.99 -8.76 -1.56 0
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395259 135025035 1 NO6C21H31 AB6C21D31 -260.98 2.23 -9.01 -0.32 0
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395260 135025036 1 NO5C18H23 AB5C18D23 -176.69 5.32 -9.1 -0.42 0
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395261 135025037 1 NO6C22H29 AB6C22D29 -222.79 7.05 -9.39 -0.28 0
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395262 135025038 1 NO4C19H23 AB4C19D23 -58.95 2.28 -8.79 -0.17 0
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395265 135025042 1 NO6C21H27 AB6C21D27 -225.31 4.86 -8.61 -0.17 0
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395266 135025043 1 ON2H16C19 AB2C16D19 67.92 5.82 -9.7 -0.92 0
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395267 135025044 2 ON3C10H13 AB3C10D13 8.27 2.61 -8.78 -1.0 -1
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395269 135025051 1 O4H16C17 A4B16C17 -117.73 4.38 -8.43 -0.3 0
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395270 135025052 1 O5H12C18 A5B12C18 -103.44 4.23 -8.8 -0.86 0
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395271 135025053 1 O5H28C32 A5B28C32 -75.04 2.75 -8.3 -0.38 0
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395272 135025054 1 O5H28C32 A5B28C32 -72.66 4.79 -8.31 -0.46 -1
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395273 135025055 1 N3H6C8 A3B6C8 127.87 6.96 0.0 0.0 0
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395274 135025056 1 BrH17C23 AB17C23 84.34 2.18 -8.81 -0.56 0
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395275 135025058 1 SN2O2C25H26 AB2C2D25E26 -14.9 4.69 -8.51 -0.98 0
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395276 135025059 1 SN5O5C19H25 AB5C5D19E25 -136.96 5.84 -9.17 -1.78 0
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395277 135025060 1 NO4C22H35 AB4C22D35 -197.72 4.43 -9.19 0.74 -1
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395278 135025061 1 INO4C22H35 ABC4D22E35 -176.33 6.0 0.0 0.0 0
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395279 135025062 1 INO4C22H36 ABC4D22E36 -209.77 3.25 -9.4 -0.85 0
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395282 135025065 1 NO5C21H37 AB5C21D37 -197.87 6.36 -9.38 0.67 0
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395283 135025066 1 ClNOC18H22 ABCD18E22 -64.92 2.12 -9.19 0.13 0
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395284 135025073 2 O3C13H16 A3B13C16 -216.06 2.26 -9.14 0.06 0
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395285 135025074 1 O6C19H28 A6B19C28 -269.82 3.83 -9.39 -0.25 0
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395286 135025085 2 OC9H9 AB9C9 -14.42 0.78 -9.36 0.2 0
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395287 135025088 2 N2O2H6C7 A2B2C6D7 -39.58 5.89 -9.57 -1.59 0
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395288 135025098 3 OC5H8 AB5C8 -151.22 5.63 -9.8 0.0 0
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395290 135025100 1 ISiO5C34H59 ABC5D34E59 -295.43 2.01 -8.85 -0.87 0
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395291 135025101 1 NSO3C26H27 ABC3D26E27 -46.03 4.79 -9.03 -0.28 0
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395292 135025102 1 NSO3C26H27 ABC3D26E27 -44.39 5.96 -8.98 -0.38 0
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395293 135025103 1 NSO3C26H27 ABC3D26E27 -50.12 6.2 -8.98 -0.42 0
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395294 135025104 1 NSO3C26H27 ABC3D26E27 -48.97 6.23 -9.03 -0.51 0