cyclopenta-1,3-diene; methanidylbenzene; methanol; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]boranuide; titanium(2+)

Systemtic Name: cyclopenta-1,3-diene; methanidylbenzene; methanol; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]boranuide; titanium(2+) Openeye Name: cyclopenta-1,3-diene; methanidylbenzene; methanol; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; titanium(2+) CAS Name: cyclopenta-1,3-diene; methanidylbenzene; methanol; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; titanium(2+) IUPAC Name: cyclopenta-1,3-diene; methanidylbenzene; methanol; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; titanium(2+) Traditional Name: cyclopenta-1,3-diene; methanidylbenzene; methanol; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; titanium(2+) Formula: C37H16BF20OTi- MolecularWeight: 915.168404

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.CO.[CH2-]C1=CC=CC=C1.C1C=CC=[C-]1.[Ti+2]

Isomeric SMILES

[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.CO.[CH2-]C1=CC=CC=C1.C1C=CC=[C-]1.[Ti+2]

InChI

InChI=1S/C24BF20.C7H7.C5H5.CH4O.Ti/c26-5-1(6(27)14(35)21(42)13(5)34)25(2-7(28)15(36)22(43)16(37)8(2)29,3-9(30)17(38)23(44)18(39)10(3)31)4-11(32)19(40)24(45)20(41)12(4)33;1-7-5-3-2-4-6-7;1-2-4-5-3-1;1-2;/h;2-6H,1H2;1-3H,4H2;2H,1H3;/q3*-1;;+2