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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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387230 134984507 1 ClNO2C13H16 ABC2D13E16 -73.13 4.41 -8.72 0.0 0
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387231 134984509 1 NO2C19H29 AB2C19D29 -92.49 1.8 -9.05 0.38 0
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387232 134984511 1 SN2O2C12H16 AB2C2D12E16 -4.82 3.81 -9.66 -0.11 0
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387233 134984512 1 NSO2C15H21 ABC2D15E21 -17.86 2.43 -8.22 0.4 0
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387234 134984517 1 NSCl3O4C13H16 ABC3D4E13F16 -162.73 3.21 -9.84 -1.07 0
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387235 134984519 1 N2O5C14H20 A2B5C14D20 -163.19 1.92 -10.44 -1.98 0
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387236 134984520 1 ClNO2C10H18 ABC2D10E18 -63.64 4.52 -10.72 -0.55 0
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387237 134984529 1 ClHNOC3F5 ABCDE3F5 -265.57 2.82 -11.63 -1.46 0
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387238 134984533 1 NO7C11H17 AB7C11D17 -253.81 5.06 -9.74 0.05 0
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387239 134984534 1 NSiO6C15H29 ABC6D15E29 -282.9 4.62 -9.22 -0.01 0
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387240 134984544 1 NCl2O2H9C13 AB2C2D9E13 22.23 3.24 -9.92 -1.0 0
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387241 134984545 1 BrC4N4O6H7 AB4C4D6E7 4.38 3.86 -9.97 -2.0 0
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387242 134984546 1 N4O8C13H24 A4B8C13D24 -86.74 1.76 -10.74 -1.7 0
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387243 134984548 1 F2H2N2C3O5 A2B2C2D3E5 -131.29 2.81 -11.79 -2.11 0
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387244 134984553 1 NO6C12H13 AB6C12D13 -153.23 2.66 -9.89 -0.96 0
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387245 134984559 1 NOC19H25 ABC19D25 12.52 0.83 -9.26 0.17 0
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387246 134984562 1 NO7C25H29 AB7C25D29 -232.33 3.49 -9.21 -0.81 0
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387247 134984564 1 ON2C19H24 AB2C19D24 17.07 1.41 -8.56 -0.16 0
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387248 134984565 1 OSN2C18H24 ABC2D18E24 12.46 2.23 -8.51 -0.48 0
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387249 134984566 2 NSO3C10H15 ABC3D10E15 -219.47 11.68 -9.66 -0.44 0
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387250 134984567 1 NOC20H25 ABC20D25 27.16 1.07 -9.22 0.29 0
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387252 134984572 2 NF2H7C9 AB2C7D9 63.98 4.51 -9.62 -0.2 0
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387253 134984573 2 NF2H7C9 AB2C7D9 58.81 0.78 -9.33 -0.02 0
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387254 134984576 1 OPC11H23 ABC11D23 -76.66 2.23 -8.12 1.25 0
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387255 134984591 1 ON2C12H26 AB2C12D26 -29.21 5.21 -9.72 0.35 1
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387256 134984594 1 Cl2N2C3H3 A2B2C3D3 50.29 2.81 0.0 0.0 0
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387257 134984616 1 NPO3F9C10H15 ABC3D9E10F15 -675.82 7.8 -10.1 0.05 0
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387258 134984618 1 NO2H11C12 AB2C11D12 1.63 1.0 -10.0 -1.06 0
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387259 134984629 1 NO2C21H25 AB2C21D25 -30.09 2.5 -9.32 0.14 0
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387260 134984630 1 NO2C22H27 AB2C22D27 -33.28 3.11 -9.19 0.2 0
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387261 134984631 1 ClNSiC23H30 ABCD23E30 32.19 3.31 -8.59 0.03 0
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387262 134984642 1 ClNO2H22C24 ABC2D22E24 6.41 3.66 -9.35 -0.26 0
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387263 134984643 1 ClNSO6H28C29 ABCD6E28F29 -156.45 7.91 -9.13 -0.86 0
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387264 134984647 1 NSiO2C11H19 ABC2D11E19 -42.93 4.63 -9.8 -0.2 0
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387265 134984657 2 NO4C7H9 AB4C7D9 -211.35 3.79 -9.37 -1.51 0
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387266 134984658 1 N4O8C13H24 A4B8C13D24 -87.1 3.5 -10.48 -1.62 0
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387267 134984663 1 NO4C11H13 AB4C11D13 -76.82 3.87 -9.77 -0.76 0
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387268 134984667 1 O4C23H32 A4B23C32 -182.37 2.66 -9.3 0.02 0
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387269 134984677 1 ClNSO3C16H16 ABCD3E16F16 -49.02 3.69 -9.3 -0.72 0
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387270 134984678 1 ClNSO3C16H16 ABCD3E16F16 -50.63 3.64 -9.35 -0.72 0
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387271 134984681 1 N3O3C22H25 A3B3C22D25 0.48 3.6 -8.32 -0.14 0
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387272 134984682 1 N3O3C22H25 A3B3C22D25 3.01 3.54 -8.32 0.0 0
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387273 134984684 1 N2O2F3C19H25 A2B2C3D19E25 -191.72 3.78 -9.22 -0.53 0
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387274 134984685 1 N2S2O6C21H34 A2B2C6D21E34 -254.21 9.74 -8.37 -0.46 -2
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387275 134984688 1 PTaSi3N4C19H48 ABC3D4E19F48 -191.88 35.27 -6.63 -1.19 0
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387277 134984703 4 NC4H5 AB4C5 104.78 0.28 -8.24 0.18 0
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387278 134984713 2 NC9H9 AB9C9 81.21 0.96 -8.28 -1.05 0
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387279 134984714 2 NC9H9 AB9C9 80.3 0.29 -8.42 -1.14 0
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387280 134984716 2 NC4H8 AB4C8 27.05 0.55 -8.72 0.59 0
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387282 134984723 1 N2O3H18C30 A2B3C18D30 77.82 2.49 -8.63 -2.26 0