Geometry & MOs

Info

ID:	191153
PubChem CID:	78112213
Reduced:	OBr2H16C19 (1)
Stoich.:	AB2C16D19 (1)
Weight, g/mol:	433.97039
ΔH_f, kcal/mol:	29.29
Dipole, Da:	2.66
IP(EA), eV:	-9.61(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1',1'-dibromo-3'-(4-methylphenyl)spiro[8,9-dihydro-7H-benzo[7]annulene-6,2'-cyclopropane]-5-one

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C(=O)C3(C1)C(C3(Br)Br)C4=CC=CC=C4

DOS

IR

Vibrations