Geometry & MOs

Info

ID:	7999
PubChem CID:	74653
Reduced:	BrO2H7C8 (1)
Stoich.:	AB2C7D8 (1)
Weight, g/mol:	213.96294
ΔH_f, kcal/mol:	-65.67
Dipole, Da:	3.65
IP(EA), eV:	-10.09(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenyl)acetic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations