List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
50921 12013515 1 NO2C18H21 AB2C18D21 -42.14 3.89 -7.99 0.07 0
50922 12013516 1 O3C12H16 A3B12C16 -118.1 3.72 -8.94 0.14 0
50923 12013517 1 O2C17H18 A2B17C18 -54.2 4.0 -9.35 -0.17 0
50924 12013518 1 O2C15H16 A2B15C16 -60.84 2.31 -9.03 -0.59 0
50925 12013519 1 FNO2C18H20 ABC2D18E20 -90.65 1.52 -8.04 -0.22 0
50926 12013520 1 ClNO2C18H20 ABC2D18E20 -52.33 3.55 -8.06 -0.37 0
50927 12013521 1 BrNO2C18H20 ABC2D18E20 -39.01 2.64 -8.06 -0.21 0
50928 12013523 1 NO2C19H23 AB2C19D23 -49.03 3.93 -7.96 0.22 0
50929 12013524 1 NO2C22H23 AB2C22D23 -26.83 2.68 -7.81 -0.42 0
50930 12013525 1 ClN2O2H11C16 AB2C2D11E16 -15.88 2.92 -8.99 -1.58 0
50931 12013526 1 ClN2O2H11C16 AB2C2D11E16 -16.68 4.32 -9.08 -1.55 0
50932 12013529 1 N3O4H11C16 A3B4C11D16 -5.27 1.04 -9.35 -1.93 0
50933 12013530 1 O2N3H11C17 A2B3C11D17 25.59 3.8 -9.26 -1.72 0
50934 12013531 1 O2N3H11C17 A2B3C11D17 26.42 6.15 -9.24 -1.86 0
50935 12013532 1 N2O2H14C17 A2B2C14D17 -17.09 4.56 -8.74 -1.31 0
50936 12013534 1 O3C17H30 A3B17C30 -180.48 3.54 -9.91 0.45 0
50937 12013536 4 OH5C7 AB5C7 -64.9 3.32 -9.34 -1.47 0
50938 12013537 1 NH21C22 AB21C22 63.2 1.45 -8.17 0.17 0
50939 12013538 1 O4C11H20 A4B11C20 -228.14 2.66 -10.67 0.82 0
50941 12013540 1 OH22C29 AB22C29 88.03 3.0 -8.25 -0.66 0
50942 12013541 1 FO4C8H11 AB4C8D11 -223.33 4.52 -10.69 -0.08 0
50943 12013542 1 FO4C8H11 AB4C8D11 -223.45 4.76 -10.69 -0.06 0
50944 12013544 2 O2H5C6 A2B5C6 -121.47 3.47 -9.72 -1.59 0
50945 12013545 1 O4C15H16 A4B15C16 -147.02 4.52 -9.57 -1.41 0
50946 12013546 1 O3H10C12 A3B10C12 -79.53 3.18 -9.61 -1.44 0
50947 12013547 1 O3H12C13 A3B12C13 -82.65 3.08 -9.6 -1.44 0
50948 12013548 1 O3H12C14 A3B12C14 -79.09 6.91 -9.81 -0.58 0
50949 12013549 1 NO2S2C13H15 AB2C2D13E15 -1.82 5.78 -8.28 -0.72 0
50950 12013550 1 NO2S2C14H15 AB2C2D14E15 23.46 6.15 -8.3 -0.79 0
50951 12013551 1 NO2S2C16H19 AB2C2D16E19 -10.2 5.9 -8.23 -0.66 0
50952 12013552 1 NO2S2C17H21 AB2C2D17E21 -14.21 6.33 -8.22 -0.66 0
50953 12013553 1 NS2O8C22H25 AB2C8D22E25 -276.43 4.52 -8.3 -0.84 0
50954 12013554 1 ON3C21H21 AB3C21D21 39.94 3.98 -8.76 -0.42 0
50955 12013555 2 ON2C9H12 AB2C9D12 -67.58 3.18 -9.03 -0.9 0
50956 12013557 1 ON4C13H16 AB4C13D16 -0.15 4.84 -9.24 -1.11 0
50957 12013558 1 ON3C11H17 AB3C11D17 -42.94 4.21 -9.12 -0.18 0
50958 12013559 1 ON3C13H15 AB3C13D15 -0.37 5.19 -9.36 -1.12 0
50960 12013562 2 ON3C12H16 AB3C12D16 -40.91 2.3 -9.11 -0.97 0
50962 12013565 1 N2O5H20C24 A2B5C20D24 -71.45 4.16 -9.72 -0.58 0
50963 12013566 1 N2O5H22C25 A2B5C22D25 -81.51 3.31 -9.4 -0.6 0
50964 12013569 1 O3C17H18 A3B17C18 -73.7 1.13 -8.94 -0.56 0
50965 12013570 1 F3O3C14H15 A3B3C14D15 -253.38 3.0 -10.39 -0.82 0
50966 12013571 1 NO5C13H15 AB5C13D15 -95.2 5.04 -10.68 -1.52 0
50967 12013572 1 O3C28H38 A3B28C38 -106.92 1.27 -8.92 0.11 0
50968 12013573 1 NO2C25H25 AB2C25D25 11.51 1.53 -8.8 -0.08 0
50969 12013574 1 O4F9H9C12 A4B9C9D12 -642.24 4.61 -9.98 -1.14 0
50970 12013576 3 FOC3H3 ABC3D3 -263.88 2.77 -8.88 -0.26 0
50971 12013577 1 O2F3C9H9 A2B3C9D9 -237.96 5.1 -9.49 -0.47 0
50972 12013578 1 O2F3C18H19 A2B3C18D19 -239.66 3.16 -8.75 0.05 0
50973 12013579 1 CrNO6C15H29 ABC6D15E29 -85.96 12.29 -7.23 -1.15 0
50974 12013580 1 CrNOC10H19 ABCD10E19 -91.79 6.34 -7.42 -0.15 0
50975 12013581 1 CrNO7C17H31 ABC7D17E31 -147.09 5.31 -7.84 -0.9 0
50976 12013582 1 CrNO6C17H31 ABC6D17E31 -235.41 6.84 -7.28 0.29 0
50977 12013583 1 CrNOC12H21 ABCD12E21 80.77 4.12 -5.94 0.98 0
50978 12013584 1 CrNO7C17H29 ABC7D17E29 -170.62 7.06 -7.49 -0.59 0
50979 12013585 1 CrNO2C12H19 ABC2D12E19 -6.34 0.47 -7.26 0.42 0
50980 12013586 1 O4C9H12 A4B9C12 -150.28 6.03 -10.28 -0.81 0
50981 12013587 1 O4C11H16 A4B11C16 -161.16 5.9 -10.23 -0.77 0
50982 12013588 1 O4C11H18 A4B11C18 -190.58 3.33 -10.05 0.15 0
50983 12013589 1 O4C13H22 A4B13C22 -199.03 4.98 -9.98 0.5 0
50984 12013590 1 NO2C7H11 AB2C7D11 -54.06 2.85 -9.63 0.23 0
50985 12013591 1 NO2C10H17 AB2C10D17 -71.13 3.67 -9.5 0.21 0
50986 12013592 1 NO2C12H13 AB2C12D13 -21.58 3.92 -9.63 -0.17 0
50987 12013593 3 N2H8C11 A2B8C11 177.07 1.1 -8.51 -0.68 0
50988 12013594 1 OSN4C14H16 ABC4D14E16 52.99 5.29 -8.8 -0.6 0
50989 12013595 1 SO3N5C14H15 AB3C5D14E15 47.08 7.12 -9.31 -1.29 0
50990 12013596 1 OSN5C16H21 ABC5D16E21 52.54 3.99 -7.92 -0.5 0
50991 12013598 1 ClOSN4C14H15 ABCD4E14F15 42.69 7.04 -8.91 -0.79 0
50992 12013599 1 SO2N4C14H16 AB2C4D14E16 18.36 10.98 -8.87 -1.21 0
50993 12013600 1 SO2N4C15H18 AB2C4D15E18 11.93 6.45 -8.38 -0.59 0
50994 12013601 1 OSN4C15H18 ABC4D15E18 42.97 5.17 -8.58 -0.62 0
50995 12013602 1 O2C9H12 A2B9C12 -73.71 5.55 -9.88 0.43 0
50996 12013603 2 OC5H7 AB5C7 -82.89 5.06 -9.66 0.48 0
50997 12013604 1 O2C9H12 A2B9C12 -78.55 5.8 -9.65 0.6 0
50998 12013606 1 O2C9H12 A2B9C12 -74.74 5.57 -9.99 0.38 0
50999 12013607 2 OC5H7 AB5C7 -79.21 5.48 -9.92 0.4 0
51000 12013608 1 O2C11H16 A2B11C16 -83.9 5.48 -9.88 0.43 0
51001 12013609 1 ON2C12H14 AB2C12D14 49.45 3.5 -9.06 -0.42 0
51002 12013610 1 ON2C12H14 AB2C12D14 51.28 3.5 -8.95 -0.68 0
51003 12013611 1 ON2H14C16 AB2C14D16 89.07 3.3 -8.9 -0.86 0
51004 12013614 2 NOH8C10 ABC8D10 66.78 3.25 -8.77 -1.03 0
51005 12013615 2 NOC6H7 ABC6D7 22.16 4.21 -9.08 -0.88 0
51006 12013616 1 N3O6C31H33 A3B6C31D33 -71.82 8.7 -8.84 -0.66 0
51007 12013618 2 N2H13C17 A2B13C17 185.59 14.6 -8.27 -0.8 0
51008 12013619 2 ON2H13C17 AB2C13D17 125.24 15.39 -8.18 -0.76 0
51009 12013621 1 FNC12H14 ABC12D14 -7.89 2.96 -8.6 0.09 0
51010 12013622 1 NC13H17 AB13C17 29.62 2.38 -8.37 0.47 0
51014 12013626 1 SO3N4C22H22 AB3C4D22E22 -37.94 7.53 -8.74 -0.76 0
51015 12013627 1 FSO3N4H21C22 ABC3D4E21F22 -85.57 7.86 -8.84 -0.8 0
51017 12013630 1 BrNPC23H25 ABCD23E25 37.72 5.78 -7.82 -0.25 0
51018 12013631 1 BrNPH27C28 ABCD27E28 74.04 3.62 -8.3 -0.24 0
51019 12013632 1 BrNPC24H27 ABCD24E27 30.3 3.24 -8.05 -0.18 0
51020 12013633 1 BrNPH25C26 ABCD25E26 58.71 3.57 -8.27 -0.23 0
51021 12013634 1 NPC22H22 ABC22D22 65.82 7.26 -7.04 -0.27 0
51022 12013635 1 NPC23H24 ABC23D24 52.29 6.15 -7.02 -0.15 0
51023 12013636 1 NPC23H24 ABC23D24 59.43 6.72 -7.1 -0.3 0
51024 12013638 1 NPH24C26 ABC24D26 75.28 5.93 -7.19 -0.34 0
51025 12013639 1 OSC19H28 ABC19D28 -54.74 2.58 -8.32 0.22 0
51026 12013640 1 SO2C19H28 AB2C19D28 -87.55 2.6 -8.25 -0.09 0
51027 12013641 1 OSC20H30 ABC20D30 -61.44 2.96 -8.45 -0.08 0