1-bromanyl-1a,9b-dihydrocyclopropa[l]phenanthren-1-ide; cobalt(2+); N-(3-nitrosobut-2-en-2-yl)hydroxylamine; 2H-pyridin-1-ide

Systemtic Name: 1-bromanyl-1a,9b-dihydrocyclopropa[l]phenanthren-1-ide; cobalt(2+); N-(3-nitrosobut-2-en-2-yl)hydroxylamine; 2H-pyridin-1-ide Openeye Name: cobaltous; 1-bromo-1a,9b-dihydrocyclopropa[l]phenanthren-1-ide; N-(1-methyl-2-nitroso-prop-1-enyl)hydroxylamine; 2H-pyridin-1-ide CAS Name: 1-bromo-1a,9b-dihydrocyclopropa[l]phenanthren-1-ide; cobalt(2+); N-(3-nitrosobut-2-en-2-yl)hydroxylamine; 2H-pyridin-1-ide IUPAC Name: 1-bromo-1a,9b-dihydrocyclopropa[l]phenanthren-1-ide; cobalt(2+); N-(3-nitrosobut-2-en-2-yl)hydroxylamine; 2H-pyridin-1-ide Traditional Name: cobaltous; 1-bromo-1a,9b-dihydrocyclopropa[l]phenanthren-1-ide; N-(1-methyl-2-nitroso-prop-1-enyl)hydroxylamine; 2H-pyridin-1-ide Formula: C28H32BrCoN5O4 MolecularWeight: 641.42198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)N=O)NO.CC(=C(C)N=O)NO.C1C=CC=C[N-]1.C1=CC=C2C(=C1)C3C([C-]3Br)C4=CC=CC=C42.[Co+2]

Isomeric SMILES

CC(=C(C)N=O)NO.CC(=C(C)N=O)NO.C1C=CC=C[N-]1.C1=CC=C2C(=C1)C3C([C-]3Br)C4=CC=CC=C42.[Co+2]

InChI

InChI=1S/C15H10Br.C5H6N.2C4H8N2O2.Co/c16-15-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)15;1-2-4-6-5-3-1;2*1-3(5-7)4(2)6-8;/h1-8,13-14H;1-4H,5H2;2*5,7H,1-2H3;/q2*-1;;;+2