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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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82357 49855932 1 O3C14H20 A3B14C20 -113.15 4.15 -9.78 -0.15 0
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82358 49855933 1 O3C13H18 A3B13C18 -118.15 5.66 -10.16 -0.37 0
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82359 49855934 1 BrNO5C16H20 ABC5D16E20 -208.83 2.58 -9.98 -0.71 0
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82360 49855937 1 Cl2O4H10C11 A2B4C10D11 -136.24 6.42 -9.41 -0.52 0
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82361 49855938 1 ClO4H9C11 AB4C9D11 -122.54 4.92 -9.52 -0.56 0
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82362 49855939 1 BrFNO2H5C8 ABCD2E5F8 -16.93 4.15 -10.24 -1.42 0
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82363 49855940 1 N4C17H26 A4B17C26 27.47 3.12 -8.5 -0.26 0
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82364 49855943 1 SO4N5C29H41 AB4C5D29E41 -105.18 7.81 -8.38 -0.68 0
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82365 49855944 1 SO4N5C26H35 AB4C5D26E35 -97.74 6.78 -8.87 -0.69 0
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82366 49855946 1 SO3N4C34H36 AB3C4D34E36 -54.71 11.67 -8.46 -0.82 0
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82367 49855947 1 SN4O4C34H36 AB4C4D34E36 -90.65 8.33 -8.66 -1.04 0
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82368 49855948 1 N5O5H29C30 A5B5C29D30 -96.3 6.12 -8.59 -0.9 0
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82369 49855949 1 ClFO2N5H27C36 ABC2D5E27F36 40.59 7.77 -8.6 -1.12 0
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82370 49855950 1 ClFO2N5H27C36 ABC2D5E27F36 40.25 4.19 -8.6 -1.15 0
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82371 49855951 1 ClFO2N5H29C36 ABC2D5E29F36 11.19 3.26 -8.63 -1.06 0
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82372 49855953 1 ClFSO3N4H18C26 ABCD3E4F18G26 -2.64 4.28 -8.69 -1.61 0
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82373 49855954 1 NO6C25H25 AB6C25D25 -152.18 8.42 -8.33 -0.18 0
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82374 49855955 1 NO7C25H25 AB7C25D25 -195.08 7.16 -8.4 -0.46 0
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82375 49855956 1 N2O6C25H26 A2B6C25D26 -151.35 6.68 -8.35 -0.2 0
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82376 49855957 1 N2O5C25H26 A2B5C25D26 -108.92 4.95 -8.33 -0.06 0
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82377 49855958 1 N2O5C25H26 A2B5C25D26 -105.05 6.32 -8.23 -0.19 0
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82378 49855960 1 BN2O6C20H33 AB2C6D20E33 -364.09 2.69 -9.04 -0.04 0
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82379 49855961 1 BClFO2C18H23 ABCD2E18F23 -200.83 3.96 -9.48 0.06 0
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82380 49855962 1 BClFO2C18H23 ABCD2E18F23 -202.68 4.1 -9.57 0.05 0
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82381 49855963 1 BClO2C19H26 ABC2D19E26 -162.05 3.12 -9.08 0.46 0