List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
123963 50868002 1 N3O3C26H29 A3B3C26D29 -46.87 8.61 -8.09 -0.73 0
123964 50868003 1 ClO2N3C25H26 AB2C3D25E26 -18.26 10.3 -8.31 -0.92 0
123965 50868004 1 N3O5C27H29 A3B5C27D29 -156.35 10.68 -8.32 -1.0 0
123966 50868005 1 ClN3O4C26H26 AB3C4D26E26 -126.11 11.67 -8.43 -1.15 0
123967 50868006 1 O2N3C26H29 A2B3C26D29 -12.01 8.43 -8.16 -0.65 0
123968 50868117 1 OSN3C27H31 ABC3D27E31 15.64 2.39 -7.69 -0.7 0
123969 50868176 1 SO2N4C32H40 AB2C4D32E40 -23.25 6.54 -7.88 -0.84 0
123970 50868177 1 N4C25H26 A4B25C26 97.58 4.76 -7.95 -0.91 0
123971 50868306 1 ON2C23H28 AB2C23D28 12.49 3.76 -7.66 -0.18 0
123972 50868307 1 ON4C19H24 AB4C19D24 21.99 7.84 -8.03 -0.46 0
123973 50868308 1 ON4C29H32 AB4C29D32 38.83 6.74 -8.07 -0.81 0
123974 50868309 1 O2N3C25H31 A2B3C25D31 -27.08 7.93 -7.77 -0.18 0
123975 50868318 1 FSN2O2C26H27 ABC2D2E26F27 -86.47 8.43 -8.04 -1.05 0
123976 50868433 1 FON3C24H28 ABC3D24E28 -33.0 7.98 -7.9 -0.55 0
123977 50868546 1 Br2O2N3C24H27 A2B2C3D24E27 -27.61 5.72 -7.96 -0.73 0
123978 50868593 1 FN3O3C27H28 AB3C3D27E28 -131.57 9.31 -8.25 -1.27 0
123979 50868594 1 N3O5C28H29 A3B5C28D29 -147.12 8.38 -8.24 -1.22 0
123980 50868626 1 O2N3C26H29 A2B3C26D29 5.14 4.69 -7.6 -0.89 0
123981 50868627 1 BrO2N3C26H28 AB2C3D26E28 8.42 4.46 -7.69 -1.17 0
123982 50868668 1 ON2C24H30 AB2C24D30 -1.04 5.02 -7.79 -0.11 0
123983 50868710 1 OSN3C27H31 ABC3D27E31 13.38 6.19 -7.93 -0.69 0
123984 50868711 1 OSN3C27H31 ABC3D27E31 15.2 4.76 -7.76 -0.73 0
123985 50868793 1 O2N3C29H33 A2B3C29D33 -5.47 7.65 -7.82 -0.27 0
123986 50868794 1 O2N3C27H31 A2B3C27D31 -16.14 9.39 -8.08 -0.74 0
123987 50868795 1 ClON3C26H28 ABC3D26E28 10.45 8.24 -8.21 -1.01 0
123988 50869043 1 ClO3N4C23H25 AB3C4D23E25 10.64 8.71 -8.36 -1.73 0
123989 50869054 1 ClN2C23H27 AB2C23D27 31.36 3.73 -7.76 -0.25 0
123990 50869138 1 ClO2N3C25H26 AB2C3D25E26 3.72 2.51 -7.87 -0.94 0
123991 50869139 1 BrClO2N3C25H25 ABC2D3E25F25 1.11 4.83 -7.96 -1.21 0
123992 50869140 1 ClIN2C22H24 ABC2D22E24 55.43 6.79 -8.14 -0.65 0
123993 50869141 1 ClSN2O2C21H25 ABC2D2E21F25 -77.66 6.52 -8.11 -0.77 0
123994 50869191 1 ClOF3N3C24H25 ABC3D3E24F25 -146.46 8.11 -8.24 -0.96 0
123995 50869264 1 ClIN2C22H24 ABC2D22E24 57.28 4.29 -8.06 -0.7 0
123996 50869265 1 FO2N3C23H26 AB2C3D23E26 -14.45 12.02 -8.35 -1.19 0
123997 50869279 1 N2Cl3C22H23 A2B3C22D23 25.05 5.65 -8.16 -0.41 0
123998 50869280 1 BrClN2C22H24 ABC2D22E24 37.86 4.09 -8.07 -0.32 0
123999 50869362 1 FOSN3C26H28 ABCD3E26F28 -22.35 1.67 -7.95 -0.7 0
124000 50869363 1 FOSN3H24C25 ABCD3E24F25 -4.97 8.34 -8.24 -1.16 0
124001 50869364 1 FSO2N3C29H34 ABC2D3E29F34 -72.01 4.59 -8.07 -0.84 0
124002 50869475 1 FO2N3C26H28 AB2C3D26E28 -53.02 9.7 -8.32 -0.95 0
124003 50869476 1 ClFON3C25H25 ABCD3E25F25 -24.87 7.19 -8.33 -0.88 0
124004 50869477 1 FOCl2N3C23H24 ABC2D3E23F24 -42.9 8.49 -8.23 -1.0 0
124005 50869551 1 FON3C27H28 ABC3D27E28 -7.85 9.54 -8.19 -0.79 0
124006 50869552 1 FCl2O2N3C26H26 AB2C2D3E26F26 -99.75 5.88 -8.06 -0.72 0
124007 50869644 1 FSN2O2C21H25 ABC2D2E21F25 -116.61 6.75 -8.14 -0.78 0
124008 50869807 1 SN2O5C23H28 AB2C5D23E28 -188.31 11.47 -8.18 -0.86 0
124009 50869808 1 SN2O5C24H30 AB2C5D24E30 -192.34 7.6 -7.96 -0.66 0
124010 50869824 1 SN3O3C34H37 AB3C3D34E37 -31.45 3.93 -7.87 -0.5 0
124011 50869878 1 ION2C23H27 ABC2D23E27 22.92 7.94 -7.9 -0.56 0
124012 50869879 1 SN2O3C22H28 AB2C3D22E28 -115.19 9.24 -8.02 -0.75 0
124013 50869880 1 SN3O4C30H35 AB3C4D30E35 -135.03 10.94 -8.14 -0.94 0
124014 50869881 1 SCl2N3O3C27H27 AB2C3D3E27F27 -79.87 12.36 -8.52 -1.35 0
124015 50869895 1 SN3O3C29H33 AB3C3D29E33 -76.71 12.81 -8.42 -1.25 0
124016 50869899 1 SN2O3C23H30 AB2C3D23E30 -114.6 6.72 -7.93 -0.58 0
124017 50869910 1 ON5C29H31 AB5C29D31 69.95 10.21 -8.09 -1.18 0
124018 50869911 1 SN2O5C24H30 AB2C5D24E30 -190.93 6.93 -7.96 -0.68 0
124019 50869915 2 NOC12H15 ABC12D15 -33.98 6.55 -7.82 -0.23 0
124020 50869928 1 ON2C27H30 AB2C27D30 23.61 6.44 -7.82 -0.31 0
124021 50869937 1 BrN3O4C28H30 AB3C4D28E30 -124.18 10.31 -8.41 -1.12 0
124022 50869938 1 N2O3C25H30 A2B3C25D30 -85.21 9.48 -7.97 -0.43 0
124023 50869939 1 ON2C29H32 AB2C29D32 29.88 6.24 -7.83 -0.12 0
124024 50869983 1 FN3O4C27H28 AB3C4D27E28 -164.49 11.24 -8.4 -1.14 0
124025 50869984 1 N3O6C28H29 A3B6C28D29 -185.11 11.46 -8.4 -1.1 0
124026 50869985 1 SN2O3C21H26 AB2C3D21E26 -107.08 8.89 -8.09 -0.74 0
124027 50869986 2 NOSC10H12 ABCD10E12 -42.9 10.72 -8.15 -1.14 0
124028 50870079 1 INOS2H12C18 ABCD2E12F18 87.66 3.5 -8.88 -1.64 0
124029 50870252 1 BrN2S2O4H5C10 AB2C2D4E5F10 -18.52 5.11 -9.43 -1.84 0
124030 50870278 1 SCl2N2O4H22C31 AB2C2D4E22F31 -28.58 6.3 -8.74 -1.73 0
124031 50870279 1 NCl2S2O3H15C19 AB2C2D3E15F19 -43.6 4.2 -8.85 -1.64 0
124032 50870280 1 OCl2N2S2H16C25 AB2C2D2E16F25 75.79 5.57 -8.54 -1.45 0
124033 50870320 1 ClNSO4H10C12 ABCD4E10F12 -123.63 3.07 -8.76 -1.58 0
124034 50870321 1 ClFNO2S2H15C23 ABCD2E2F15G23 -11.96 6.4 -8.74 -1.44 0
124035 50870328 1 BrFNS2O3H17C24 ABCD2E3F17G24 -34.02 2.68 -8.73 -1.57 0
124036 50870349 1 ClON2S2H17C20 ABC2D2E17F20 57.35 8.9 -8.27 -1.59 0
124037 50870388 1 NS2O4C26H29 AB2C4D26E29 -72.68 2.91 -8.64 -1.69 0
124038 50870524 1 ClO2N7C26H30 AB2C7D26E30 46.04 4.21 -8.15 -0.37 0
124039 50870561 1 SO3N7C26H31 AB3C7D26E31 9.85 4.68 -8.46 -0.98 0
124040 50870631 1 FO3N7C29H30 AB3C7D29E30 -0.26 3.17 -8.29 -0.6 0
124041 50870742 1 N2S3O6H14C22 A2B3C6D14E22 -24.79 7.65 -9.07 -1.78 0
124042 50870858 1 ClNS2O3H18C24 ABC2D3E18F24 -0.43 6.01 -8.7 -1.43 0
124043 50870859 1 BrFNO2S2H15C20 ABCD2E2F15G20 -16.17 4.97 -8.89 -1.58 0
124044 50870898 1 NBr2O2S2H23C27 AB2C2D2E23F27 23.41 1.81 -8.9 -1.59 0
124045 50870922 1 BrClFNSO3H14C23 ABCDEF3G14H23 -76.53 2.35 -9.38 -1.46 0
124046 50870932 1 ClNS2O5H16C20 ABC2D5E16F20 -110.53 1.81 -9.15 -1.66 0
124047 50870933 1 FNS2O3H18C24 ABC2D3E18F24 -42.32 4.26 -8.73 -1.3 0
124048 50870934 1 FNS2O3H18C24 ABC2D3E18F24 -45.15 2.0 -8.8 -1.49 0
124049 50870935 1 FNO2S2H22C23 ABC2D2E22F23 -51.28 3.02 -9.02 -1.42 0
124050 50870936 1 FNO2S2H22C23 ABC2D2E22F23 -51.79 4.15 -9.01 -1.4 0
124051 50871132 1 ClFNS2O5H15C20 ABCD2E5F15G20 -159.93 7.38 -8.76 -1.92 0
124052 50871153 1 ClFNS2O4H13C19 ABCD2E4F13G19 -123.11 7.18 -9.14 -1.72 0
124053 50871258 1 FNCl2O2S2H14C23 ABC2D2E2F14G23 -19.45 6.55 -9.06 -1.67 0
124054 50871259 1 ClFNS2O3C25H25 ABCD2E3F25G25 -103.55 4.81 -8.42 -1.42 0
124055 50871343 1 NS2O6H15C18 AB2C6D15E18 -167.74 4.84 -8.88 -1.14 0
124056 50871403 1 SN2O7C15H16 AB2C7D15E16 -243.51 5.04 -8.9 -1.51 0
124057 50871404 1 SN2O5H18C23 AB2C5D18E23 -72.76 3.42 -8.9 -1.56 0
124058 50871405 1 FN2O5H17C24 AB2C5D17E24 -113.53 3.14 -8.94 -1.53 0
124059 50871445 1 FNS3O7H14C19 ABC3D7E14F19 -226.04 5.15 -9.16 -2.13 0
124060 50871517 1 OF2N2S2H16C25 AB2C2D2E16F25 -1.38 6.34 -8.54 -1.49 0
124061 50871527 1 N3S3O9H15C23 A3B3C9D15E23 -66.13 8.02 -8.94 -2.08 0
124062 50871643 1 N2S3O7H16C20 A2B3C7D16E20 -78.33 6.96 -8.88 -1.91 0