Geometry & MOs

Info

ID:	284535
PubChem CID:	104051635
Reduced:	BrO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	431.89503
ΔH_f, kcal/mol:	-88.84
Dipole, Da:	5.54
IP(EA), eV:	-8.95(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-2-chlorophenyl)-(5-bromo-2-methoxy-3,6-dimethylphenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OC)C(=O)CC(C)(C)C)C)Br

DOS

IR

Vibrations