List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
4923 12284 2 O2C3H5 A2B3C5 -196.25 6.17 -10.95 -0.15 0
4924 12285 1 O3C7H10 A3B7C10 -137.24 1.69 -10.42 0.28 0
4925 12286 1 BrNH4C5 ABC4D5 36.9 2.09 -10.0 -0.62 0
4926 12291 1 NC6H13 AB6C13 -16.09 1.63 -8.53 3.01 0
4927 12292 1 O4C7H12 A4B7C12 -198.84 2.47 -11.0 0.3 0
4928 12293 1 O2C9H18 A2B9C18 -129.43 1.68 -10.79 0.86 0
4929 12294 2 OC5H10 AB5C10 -133.81 2.07 -10.72 0.84 0
4930 12297 1 OC6H14 AB6C14 -81.36 2.04 -10.41 2.93 0
4931 12298 1 NOC5H11 ABC5D11 -68.52 3.87 -10.43 1.18 0
4932 12299 1 O2C5H8 A2B5C8 -83.82 5.8 -10.91 -0.16 0
4933 12300 1 ClO2C4H7 AB2C4D7 -111.3 3.93 -10.82 0.44 0
4934 12301 1 O3C4H8 A3B4C8 -135.21 5.8 -10.79 0.57 0
4935 12303 1 ON2C4H10 AB2C4D10 -61.3 3.65 -9.94 1.19 0
4936 12304 1 OC6H14 AB6C14 -72.5 1.49 -9.63 2.36 0
4937 12305 1 Cl2O2C3H4 A2B2C3D4 -105.31 2.58 -11.0 -0.87 0
4938 12307 1 NC3O3H7 AB3C3D7 -48.88 3.58 -11.66 -0.95 0
4939 12308 1 BrOC3H7 ABC3D7 -58.44 1.94 -10.53 -0.12 0
4940 12310 1 C5H8 A5B8 30.77 0.19 -9.95 2.04 0
4941 12311 1 ClC4H5 AB4C5 19.25 1.62 -9.51 -0.22 0
4942 12312 1 ClC4H5 AB4C5 23.27 2.24 -9.8 0.14 0
4943 12314 1 I2C3H6 A2B3C6 14.41 1.42 -9.94 -1.18 0
4944 12315 1 NC4H11 AB4C11 -14.04 1.75 -8.9 3.1 0
4945 12317 1 FOC3H7 ABC3D7 -97.9 0.36 -10.05 1.99 0
4947 12321 1 SC4H6 AB4C6 35.12 1.23 -8.48 0.5 0
4948 12322 2 C4H7 A4B7 -1.35 1.45 -9.59 1.28 0
4949 12324 2 ClHOC2 ABCD2 -70.99 0.01 -11.63 -2.36 0
4950 12326 1 ClO2N4C6H15 AB2C4D6E15 -116.05 5.87 -9.67 0.09 0
4951 12329 2 O2C4H7 A2B4C7 -196.5 0.84 -11.04 0.67 0
4952 12330 8 CH2 AB2 -25.74 0.68 -9.09 1.63 0
4953 12331 1 OC7H16 AB7C16 -80.46 2.04 -10.36 2.69 0
4954 12332 1 NOC6H13 ABC6D13 -73.57 3.92 -10.44 1.17 0
4955 12333 1 NO2C5H11 AB2C5D11 -38.92 4.41 -10.8 -0.29 0
4956 12335 1 IC5H11 AB5C11 -13.92 1.95 -9.75 -0.75 0
4957 12336 1 ClNC4H6 ABC4D6 4.19 3.25 -10.92 0.54 0
4958 12340 1 OC5H12 AB5C12 -63.7 1.5 -9.6 2.29 0
4959 12341 1 ClOC4H9 ABC4D9 -65.1 2.28 -10.04 0.56 0
4960 12342 2 CNOH2 ABCD2 -51.71 0.02 -9.38 0.08 0
4961 12346 1 OC8H18 AB8C18 -78.69 1.36 -9.48 2.35 0
4962 12347 1 ClC8H17 AB8C17 -56.33 2.51 -10.46 1.02 0
4963 12349 1 NO3C5H11 AB3C5D11 -140.95 1.87 -9.86 0.6 0
4964 12350 1 C7H12 A7B12 25.94 1.22 -10.61 1.81 0
4965 12352 1 NC6H11 AB6C11 0.85 4.02 -11.55 1.32 0
4966 12354 1 I2C5H10 A2B5C10 3.7 1.53 -9.87 -0.94 0
4968 12359 1 HgC2N2O2 AB2C2D2 60.32 0.05 -10.25 0.15 0
4969 12361 1 ClO2C4H9 AB2C4D9 -104.87 1.56 -10.39 0.35 0
4970 12362 1 O3C4H10 A3B4C10 -132.34 1.44 -10.22 1.68 0
4971 12363 1 C7H12 A7B12 -5.92 0.38 -9.37 1.52 0
4972 12364 2 NOC3H6 ABC3D6 -114.11 7.93 -9.93 0.65 0
4973 12365 1 CH2N2O6 AB2C2D6 -62.83 2.57 -12.25 -1.69 0
4974 12366 2 OC9H18 AB9C18 -170.46 1.7 -10.55 0.89 0