List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
327426 126689873 1 N7O9C38H69 A7B9C38D69 -473.94 7.85 -8.76 0.45 0
327427 126689876 1 N2O3C14H26 A2B3C14D26 -142.55 5.26 -9.43 0.31 0
327428 126689878 1 NC8H13 AB8C13 31.56 1.18 -8.14 0.25 0
327429 126689885 1 N5O8C42H43 A5B8C42D43 -184.26 5.45 -8.74 -0.72 0
327430 126689886 1 N8O11C59H66 A8B11C59D66 -296.95 3.9 -8.25 -1.57 0
327431 126689896 1 ClFON5C23H27 ABCD5E23F27 -37.23 7.28 -8.5 -0.97 0
327432 126689897 1 ClFON5C22H23 ABCD5E22F23 5.44 7.11 -8.45 -0.96 0
327433 126689898 1 IF2O2N4H9C15 AB2C2D4E9F15 -0.03 4.04 -9.48 -2.14 0
327434 126689902 1 ClFO3N5C27H33 ABC3D5E27F33 -122.02 10.78 -8.29 -0.32 0
327435 126689904 1 ClFO3N5C28H31 ABC3D5E28F31 -58.91 4.27 -8.7 -1.27 0
327436 126689905 1 ClFO2N5C23H25 ABC2D5E23F25 -71.16 7.31 -8.56 -1.01 0
327437 126689907 1 ClOF2N5C21H22 ABC2D5E21F22 -71.66 7.64 -8.53 -1.01 0
327438 126689909 1 ClFO2N5C25H31 ABC2D5E25F31 -93.12 7.31 -8.33 -0.52 0
327439 126689912 1 ClFO2N5C26H27 ABC2D5E26F27 2.54 8.37 -8.6 -1.05 0
327440 126689914 1 ClFON5H19C21 ABCD5E19F21 66.45 6.31 -8.56 -1.01 0
327441 126689915 1 ClFON5C21H23 ABCD5E21F23 -21.41 6.18 -8.56 -1.01 0
327442 126689917 1 FON4C25H29 ABC4D25E29 -33.11 5.47 -8.31 -0.82 0
327443 126689919 1 N5O8C42H43 A5B8C42D43 -184.04 6.97 -8.76 -0.86 0
327444 126689920 1 ClFON4C24H26 ABCD4E24F26 -12.14 5.22 -8.82 -1.11 0
327445 126689921 1 ClFO2N5C27H31 ABC2D5E27F31 -63.21 10.45 -8.49 -0.93 0
327446 126689923 1 ClFO2N5C26H29 ABC2D5E26F29 -67.13 9.26 -8.57 -1.03 0
327447 126689927 1 FIO2N6C31H38 ABC2D6E31F38 -31.85 10.65 -8.46 -1.14 0
327448 126689932 1 PC12H23 AB12C23 -10.46 2.05 -8.95 2.8 0
327449 126689936 1 NC12H23 AB12C23 -31.02 1.75 -8.89 3.1 0
327450 126689938 1 N2C11H22 A2B11C22 -13.55 2.95 -8.28 2.65 0
327451 126689941 1 O3C15H20 A3B15C20 -48.87 2.03 -8.98 0.14 0
327452 126689944 1 IN2H5C6 AB2C5D6 117.08 2.36 -9.2 -1.76 0
327453 126689952 1 F2O3C17H18 A2B3C17D18 -201.77 4.01 -9.09 -0.21 0
327454 126689955 1 N4O4C13H22 A4B4C13D22 -161.24 4.37 -9.81 -0.17 0
327455 126689958 1 O5C23H30 A5B23C30 -212.13 7.81 -9.61 0.14 0
327456 126689959 1 N5O6C18H31 A5B6C18D31 -291.73 7.14 -9.7 0.13 0
327457 126689960 1 O3C23H32 A3B23C32 -140.86 3.22 -9.47 0.28 0
327458 126689961 1 NO3C22H39 AB3C22D39 -177.57 9.35 -9.76 0.79 0
327459 126689965 1 BrN2O2C13H13 AB2C2D13E13 -35.44 2.68 -9.53 -0.76 0
327460 126689966 1 FN2O2C13H13 AB2C2D13E13 -84.98 1.46 -9.55 -0.73 0
327461 126689967 1 ClN2O2C13H13 AB2C2D13E13 -47.27 1.54 -9.56 -0.75 0
327462 126689978 1 BrClFO3N4H15C24 ABCD3E4F15G24 133.59 8.37 -8.79 -1.62 0
327463 126689989 1 ClFON6C32H38 ABCD6E32F38 13.96 10.4 -8.69 -0.76 0
327464 126689990 1 FIO2N5C26H27 ABC2D5E26F27 -15.1 10.19 -8.48 -1.14 0
327465 126689991 1 FIO3N5C25H27 ABC3D5E25F27 -5.0 3.79 -8.64 -1.74 0
327466 126689995 1 FION5C23H29 ABCD5E23F29 -9.94 5.45 -8.07 -1.09 0
327467 126689999 1 ClFO2N6C29H36 ABC2D6E29F36 -13.74 10.53 -8.52 -0.57 0
327468 126690001 1 ClFN6C25H30 ABC6D25E30 13.05 8.47 -8.56 -0.92 0
327469 126690009 1 ClO2N5C29H34 AB2C5D29E34 -12.42 8.0 -8.67 -0.96 0
327470 126690013 1 PC7H13 AB7C13 -1.69 1.6 -8.75 2.57 0
327471 126690014 1 NC14H25 AB14C25 -29.53 2.2 -8.93 1.43 0
327472 126690018 1 FIN6C24H28 ABC6D24E28 38.27 4.55 -8.44 -1.33 0
327473 126690033 1 FCl2O2N5C26H28 AB2C2D5E26F28 -60.22 2.85 -8.84 -1.45 0
327474 126690034 1 ClFON4H18C21 ABCD4E18F21 54.02 7.33 -8.48 -0.95 0
327475 126690045 1 FO2S2N6C26H29 AB2C2D6E26F29 -5.51 5.87 -8.73 -0.96 0
327476 126690051 1 OSN8C18H20 ABC8D18E20 101.46 8.63 -8.91 -1.1 0
327477 126690053 1 IN2C6H9 AB2C6D9 62.79 2.92 -9.01 -0.94 0
327478 126690060 1 FO2S2N6H25C26 AB2C2D6E25F26 47.29 6.33 -8.83 -1.32 0
327479 126690061 1 FOS2N6C25H29 ABC2D6E25F29 34.23 5.86 -8.6 -0.88 0
327480 126690064 1 FSO3N7C29H38 ABC3D7E29F38 -73.07 6.03 -8.32 -0.97 0
327481 126690065 1 SC11H20 AB11C20 -29.24 2.6 -8.35 0.9 0
327482 126690067 1 FOSN8C25H25 ABCD8E25F25 83.17 5.07 -8.9 -1.32 0
327483 126690068 1 FOSN5C18H24 ABCD5E18F24 -3.3 4.3 -8.01 -0.46 0
327484 126690070 1 FOPS2N6C25H32 ABCD2E6F25G32 4.57 4.11 -8.57 -0.62 0
327485 126690072 1 FS2N7C24H28 AB2C7D24E28 87.68 5.24 -8.51 -0.83 0
327486 126690074 1 FOPSN5C24H29 ABCDE5F24G29 -11.89 1.84 -8.6 -0.75 0
327487 126690078 1 FOS2N8C28H37 ABC2D8E28F37 39.48 5.73 -8.44 -0.89 0
327488 126690079 1 FOSN8C29H35 ABCD8E29F35 50.78 7.28 -8.42 -0.65 0
327489 126690093 1 FOS2N7C25H30 ABC2D7E25F30 49.52 4.4 -8.58 -0.83 0
327490 126690094 1 ClFOS2N7C27H31 ABCD2E7F27G31 42.03 3.29 -8.64 -0.86 0
327491 126690095 1 FOSN7C27H32 ABCD7E27F32 89.06 5.57 -8.86 -1.22 0
327492 126690096 1 FS2N6C24H25 AB2C6D24E25 101.22 2.43 -8.65 -1.07 0
327493 126690100 1 IPO4C24H42 ABC4D24E42 -261.97 3.55 -9.55 -0.91 0
327494 126690106 1 O5C19H30 A5B19C30 -193.44 3.85 -9.22 0.03 0
327495 126690111 1 O3H16C17 A3B16C17 -92.37 2.3 -9.78 -0.92 0
327496 126690133 1 FS2N7C24H28 AB2C7D24E28 85.07 3.97 -8.51 -0.84 0
327497 126690135 1 OSN6C26H34 ABC6D26E34 71.42 5.35 -8.36 -0.76 0
327498 126690140 1 FSN6C23H27 ABC6D23E27 69.97 8.03 -8.46 -0.64 0
327499 126690146 1 FOS2N7C24H28 ABC2D7E24F28 45.66 4.89 -8.57 -0.94 0
327500 126690147 1 FOS2N7C24H28 ABC2D7E24F28 51.2 7.22 -8.56 -0.89 0