tert-butylcyclopentane; cobalt(3+); 1,2-diphenylcycloheptane; tetrafluoroborate

Systemtic Name: tert-butylcyclopentane; cobalt(3+); 1,2-diphenylcycloheptane; tetrafluoroborate Openeye Name: cobaltic; tert-butylcyclopentane; 1,2-diphenylcycloheptane; tetrafluoroborate CAS Name: tert-butylcyclopentane; cobalt(3+); 1,2-diphenylcycloheptane; tetrafluoroborate IUPAC Name: tert-butylcyclopentane; cobalt(3+); 1,2-diphenylcycloheptane; tetrafluoroborate Traditional Name: cobaltic; tert-butylcyclopentane; 1,2-diphenylcycloheptane; tetrafluoroborate Formula: C28H30BCoF4+2 MolecularWeight: 512.275613

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C)(C)[C]1[CH][CH][CH][CH]1.C1C[CH][C]([C]([CH][CH]1)C2=CC=CC=C2)C3=CC=CC=C3.[Co+3]

Isomeric SMILES

[B-](F)(F)(F)F.CC(C)(C)[C]1[CH][CH][CH][CH]1.C1C[CH][C]([C]([CH][CH]1)C2=CC=CC=C2)C3=CC=CC=C3.[Co+3]

InChI

InChI=1S/C19H17.C9H13.BF4.Co/c1-4-10-16(11-5-1)18-14-8-3-9-15-19(18)17-12-6-2-7-13-17;1-9(2,3)8-6-4-5-7-8;2-1(3,4)5;/h1-2,4-8,10-15H,3,9H2;4-7H,1-3H3;;/q;;-1;+3