Geometry & MOs

Info

ID:	150246
PubChem CID:	53789933
Reduced:	O2C25H26 (1)
Stoich.:	A2B25C26 (1)
Weight, g/mol:	249.99933
ΔH_f, kcal/mol:	-9.58
Dipole, Da:	1.55
IP(EA), eV:	-8.69(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-4-phenylcyclohex-3-en-1-one

Drug info:

PubChemData

Smile

CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCOC)C3=CC=CC=C3

DOS

IR

Vibrations