Geometry & MOs

Info

ID:	287854
PubChem CID:	104296480
Reduced:	BrO2H15C16 (1)
Stoich.:	AB2C15D16 (1)
Weight, g/mol:	264.01498
ΔH_f, kcal/mol:	-37.46
Dipole, Da:	4.0
IP(EA), eV:	-8.96(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-bromo-3-methylphenyl)-(cyclopenten-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)C(=O)C2=CC(=C(C=C2)Br)C

DOS

IR

Vibrations