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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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1890 5282 1 NO4C25H50 AB4C25D50 -242.35 6.33 0.0 0.0 1
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1891 5284 2 O2C15H19 A2B15C19 -156.93 5.14 -9.16 -0.89 0
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1892 5287 2 O2C15H20 A2B15C20 -160.24 6.1 -8.92 -0.86 0
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1893 5288 1 O4C31H42 A4B31C42 -161.37 4.75 -8.69 -0.97 0
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1894 5290 1 NO4C19H21 AB4C19D21 -117.74 5.4 -8.44 0.0 0
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1895 5291 1 ON7C29H31 AB7C29D31 83.47 6.57 -8.49 -0.68 0
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1896 5292 1 O5C30H42 A5B30C42 -178.63 2.22 -8.33 -0.36 0
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1897 5294 1 O5C26H42 A5B26C42 -176.72 5.89 -9.14 -0.39 0
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1898 5297 1 N7O12C21H39 A7B12C21D39 -483.46 5.27 -9.51 -0.19 0
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1899 5298 1 N4O8H22C25 A4B8C22D25 -197.82 9.69 -8.91 -2.0 0
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1900 5299 1 N3O7C8H15 A3B7C8D15 -247.84 2.26 -10.18 -0.79 0
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1901 5300 1 N3O7C8H15 A3B7C8D15 -260.86 2.73 -10.5 -1.13 0
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1902 5303 1 O6C23H32 A6B23C32 -277.91 6.65 -10.08 -0.74 0
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1903 5304 1 N2O2C21H22 A2B2C21D22 34.96 5.23 -8.71 -0.01 0
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1904 5305 1 N2O2C25H30 A2B2C25D30 -41.29 2.57 -8.98 -1.01 0
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1905 5309 1 SN3O3C19H21 AB3C3D19E21 -70.23 2.16 -8.4 -1.24 0
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1906 5310 1 OC15H22 AB15C22 -47.39 3.78 -9.87 0.05 0
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1907 5311 1 N2O3C14H20 A2B3C14D20 -98.64 4.86 -8.86 0.1 0
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1908 5312 1 O4C7H10 A4B7C10 -186.4 4.73 -10.27 0.02 0
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1909 5318 1 SN2Cl3H15C18 AB2C3D15E18 51.13 3.01 -9.41 -1.01 0
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1910 5324 1 SO2N4C7H10 AB2C4D7E10 -48.82 5.98 -9.05 -0.15 0
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1911 5328 1 O2S2N4C9H10 A2B2C4D9E10 -12.44 10.21 -8.98 -0.77 0
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1912 5331 1 NS2C9O10H15 AB2C9D10E15 -416.29 4.69 -10.77 -1.48 0
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1913 5332 1 SO3N4C11H12 AB3C4D11E12 -61.17 8.75 -9.39 -0.56 0
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1914 5333 1 SN2O2C6H8 AB2C2D6E8 -55.93 6.79 -9.16 -0.27 0
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1915 5334 1 SN3O5H13C14 AB3C5D13E14 -89.68 9.79 -9.46 -1.19 0
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1916 5335 1 SO2N4H14C15 AB2C4D14E15 21.51 9.45 -9.06 -0.49 0
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1917 5340 1 O2S2N3C9H9 A2B2C3D9E9 -19.88 9.22 -8.55 -0.66 0
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1918 5341 1 O2S2N3C7H9 A2B2C3D7E9 -48.1 6.32 -9.13 -0.54 0
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1919 5343 1 SO2N4C12H14 AB2C4D12E14 -39.98 6.8 -9.19 -0.29 0
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1920 5345 2 SBr2H5O5C10 AB2C5D5E10 -316.28 4.29 -10.1 -2.01 0
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1921 5350 1 NOS2C6H11 ABC2D6E11 -5.03 4.88 -8.65 -0.07 0
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1922 5354 1 NOSC20H35 ABCD20E35 -84.18 5.14 -8.65 -0.13 0
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1923 5358 1 SO2N3C14H21 AB2C3D14E21 -48.82 2.54 -8.36 -0.02 0
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1924 5359 1 SO3H12C14 AB3C12D14 -71.54 3.98 -9.55 -1.2 0
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1925 5360 1 N6Na6S6O23H34C51 A6B6C6D23E34F51 -601.66 97.73 -3.55 -2.77 0
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1926 5361 1 N6S6O23H40C51 A6B6C23D40E51 -754.78 7.83 -9.47 -2.34 0
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1927 5362 2 NO3C12H13 AB3C12D13 -202.87 2.63 -8.94 -0.42 0
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1928 5368 1 N5O7H29C31 A5B7C29D31 -130.63 4.26 -8.67 -1.11 0
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1929 5374 1 SN3C10H15 AB3C10D15 41.73 1.6 -8.67 -0.24 0
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1930 5375 1 O5N7C17H23 A5B7C17D23 -194.2 8.17 -9.21 -0.3 0
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1931 5377 1 NO2C26H29 AB2C26D29 -14.25 2.26 -8.51 0.16 0
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1932 5379 1 FN3O4C19H22 AB3C4D19E22 -146.59 12.5 -9.15 -1.29 0
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1933 5381 1 NSO2C21H21 ABC2D21E21 -1.65 5.65 -8.42 -1.27 0
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1935 5386 1 FN2O3C8H9 AB2C3D8E9 -162.58 5.39 -9.98 -0.84 0
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1936 5387 1 SO2N4C19H22 AB2C4D19E22 -24.72 6.03 -8.6 -0.69 0
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1937 5392 1 P2S3O6C16H20 A2B3C6D16E20 -342.7 3.99 -8.62 -0.62 0
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1938 5395 1 NO2C9H19 AB2C9D19 -101.69 1.75 -9.33 1.6 0
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1939 5398 2 N2O2C11H15 A2B2C11D15 -152.35 1.47 -9.46 -0.49 0
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1940 5399 1 OC23H38 AB23C38 -73.54 3.87 -9.0 0.83 0
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1941 5400 1 NOC12H15 ABC12D15 -14.27 3.96 -8.87 -0.51 0
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1942 5401 1 O4N5C19H25 A4B5C19D25 -106.68 2.71 -8.21 -0.44 0
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1943 5404 1 Cl2O3N5C26H31 A2B3C5D26E31 -39.25 4.88 -8.28 -0.78 0
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1944 5405 1 NO2C32H41 AB2C32D41 -57.52 2.74 -8.5 0.08 0
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1945 5406 1 ON4C20H28 AB4C20D28 -22.8 3.95 -8.19 0.22 0
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1946 5407 1 O3C19H24 A3B19C24 -134.44 5.37 -10.0 -0.61 0
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1947 5409 1 O3C26H40 A3B26C40 -192.82 4.62 -9.75 0.04 0
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1948 5410 1 O3C22H32 A3B22C32 -174.2 6.74 -9.74 0.04 0
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1949 5412 2 NO4C11H12 AB4C11D12 -302.26 2.92 -8.95 -1.08 0
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1950 5413 1 NC8H20 AB8C20 3.3 0.02 0.0 0.0 1
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1951 5414 1 O5C16H34 A5B16C34 -258.93 6.12 -9.18 1.62 0
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1952 5415 1 SN6O8C37H42 AB6C8D37E42 -288.47 9.5 -8.74 -0.44 0
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1953 5417 1 NO4C21H25 AB4C21D25 -110.36 3.96 -8.07 0.28 0
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1954 5418 1 NO4C20H25 AB4C20D25 -112.45 3.85 -8.11 0.15 0
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1955 5420 1 P2O3N4C12H32 A2B3C4D12E32 -312.25 4.78 -9.35 0.66 0
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1956 5421 3 NOC8H8 ABC8D8 -44.36 1.81 0.0 0.0 1
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1957 5422 2 NO3C19H21 AB3C19D21 -120.6 6.7 -7.92 0.09 0
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1958 5423 1 O3C16H26 A3B16C26 -136.79 4.03 -9.7 -0.37 0
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1959 5424 2 H2C3O3 A2B3C3 -183.81 1.82 -9.68 -2.28 0
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1960 5426 1 N2O4H10C13 A2B4C10D13 -132.51 6.55 -10.49 -1.74 0
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1961 5428 2 O6C17H25 A6B17C25 -556.26 8.98 -9.5 0.21 0
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1962 5429 1 O2N4C7H8 A2B4C7D8 -49.49 4.66 -9.25 -0.68 0
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1963 5437 1 NSO2C3H3 ABC2D3E3 -82.89 2.08 -10.13 -1.03 0
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1964 5438 1 SN3C8H8 AB3C8D8 56.36 3.75 0.0 0.0 1
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1965 5443 1 SO2H6C7 AB2C6D7 -58.18 6.17 -9.37 -0.89 0