Geometry & MOs

Info

ID:	10376
PubChem CID:	101346
Reduced:	BrO2H7C9 (1)
Stoich.:	AB2C7D9 (1)
Weight, g/mol:	225.96294
ΔH_f, kcal/mol:	-43.85
Dipole, Da:	5.62
IP(EA), eV:	-10.06(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-bromophenyl)prop-2-enoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C=CC(=O)O)Br

DOS

IR

Vibrations