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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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9220 87214 1 NOH21C29 ABC21D29 114.46 13.02 -7.44 -1.66 0
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9221 87215 1 NOH22C29 ABC22D29 94.49 1.44 0.0 0.0 1
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9222 87216 1 O4N5C15H23 A4B5C15D23 -133.79 3.74 -8.93 -0.54 0
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9223 87217 2 S2C3O3H7 A2B3C3D7 -287.18 1.49 -8.8 -0.96 0
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9224 87220 1 O2C21H42 A2B21C42 -185.05 1.76 -10.47 0.91 0
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9225 87221 2 OC22H44 AB22C44 -290.83 2.16 -10.51 0.87 0
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9226 87230 1 ScH3O3 AB3C3 -234.65 1.47 -10.45 -0.11 0
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9227 87252 1 N3O3C10H13 A3B3C10D13 -89.5 1.34 -9.12 -0.46 0
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9228 87270 2 NC6H8 AB6C8 24.84 2.64 -8.05 0.27 0
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9229 87280 1 SiO2C10H24 AB2C10D24 -216.38 2.05 -9.19 1.57 0
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9230 87294 1 ON4C20H20 AB4C20D20 56.5 7.87 -8.3 -0.94 0
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9231 87302 1 NOSC5H9 ABCD5E9 -23.79 3.34 -8.91 0.41 0
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9232 87315 1 N5O7H19C25 A5B7C19D25 1.88 4.09 -8.43 -2.7 0
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9233 87316 1 FN2O2H5C6 AB2C2D5E6 -31.84 4.09 -9.33 -1.36 0
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9234 87323 2 NCl2C3 AB2C3 51.68 3.79 -10.27 -2.07 0
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9235 87328 6 OC3H3 AB3C3 -177.88 3.11 -10.58 -1.27 0
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9236 87354 1 SiO2C10H14 AB2C10D14 -124.66 2.48 -9.39 0.13 0
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9237 87355 1 NS3H9O9C10 AB3C9D9E10 -325.65 5.82 -9.44 -2.17 0
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9238 87361 1 SiO6C10H20 AB6C10D20 -395.71 1.03 -10.77 -0.18 0
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9239 87370 1 OC7H16 AB7C16 -73.71 1.58 -9.66 2.39 0
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9240 87371 1 ON2H10C11 AB2C10D11 -3.71 3.5 -8.65 -0.49 0
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9241 87372 2 NOC6H6 ABC6D6 -42.54 3.23 -8.27 -0.59 0
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9242 87376 1 SiO4C11H22 AB4C11D22 -234.31 1.82 -9.99 0.54 0
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9243 87377 1 OSi2N4C11H20 AB2C4D11E20 -78.93 3.68 -9.19 -0.44 0
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9244 87406 1 Cl2O4H6C15 A2B4C6D15 -103.56 4.38 -10.0 -2.24 0
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9245 87441 4 OC3H4 AB3C4 -151.68 1.64 -8.36 0.12 0
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9246 87443 2 NC5H10 AB5C10 -2.66 2.55 -9.24 1.14 0
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9247 87444 1 NO2H15C16 AB2C15D16 -32.8 6.2 -8.18 -0.54 0
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9248 87457 2 SiO2C6H13 AB2C6D13 -316.08 1.83 -10.07 0.56 0
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9249 87460 1 Cl2O2H6C7 A2B2C6D7 -74.31 1.08 -8.7 -0.69 0
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9250 87461 1 ClNSO6H12C20 ABCD6E12F20 -144.97 6.92 -8.9 -2.04 0
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9251 87478 1 ClNSiC6H12 ABCD6E12 -55.22 1.84 -10.15 0.32 0
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9252 87483 1 SiCl2O2C5H10 AB2C2D5E10 -193.76 2.08 -10.4 -0.2 0
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9253 87495 1 SiO2C6H16 AB2C6D16 -150.86 1.77 -9.73 1.33 0
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9254 87503 1 NO2C24H47 AB2C24D47 -173.24 3.74 -9.48 1.02 0
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9255 87504 1 NPO8C36H72 ABC8D36E72 -532.88 12.25 -9.98 -0.25 0
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9256 87515 2 NO2C5H7 AB2C5D7 -78.85 5.62 -9.1 -1.05 0
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9257 87517 1 ClNPO5H13C17 ABCD5E13F17 -222.19 4.68 -8.91 -1.25 0
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9258 87527 1 N2S2O6H26C27 A2B2C6D26E27 -95.61 25.94 -8.84 -2.42 0
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9259 87536 1 NO2C5H11 AB2C5D11 -106.91 5.5 -9.94 0.88 0
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9260 87547 1 PbC10H22 AB10C22 -7.34 1.5 -8.18 -1.71 0
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9261 87563 1 PC18H31 AB18C31 -41.24 1.48 -8.28 0.42 0
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9262 87565 1 O2C25H48 A2B25C48 -150.23 2.29 -10.37 -0.16 0
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9263 87566 1 O2P2S5C8H20 A2B2C5D8E20 -226.8 1.27 -8.98 -0.6 0
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9264 87573 1 SSi2O4C6H18 AB2C4D6E18 -300.45 3.9 -10.09 -0.42 0
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9265 87578 1 C7O8H14 A7B8C14 -366.35 2.45 -10.62 0.02 0
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9266 87597 1 O2C9H16 A2B9C16 -110.93 0.71 -10.11 0.21 0
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9267 87612 1 NO6C20H41 AB6C20D41 -346.95 2.66 -10.25 0.49 0
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9268 87616 1 NO2C8H15 AB2C8D15 -85.56 4.33 -10.4 1.25 0
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9269 87618 1 SiCl3C7H13 AB3C7D13 -148.58 2.09 -10.41 -0.58 0