Geometry & MOs

Info

ID:	27398
PubChem CID:	821103
Reduced:	O3C5H5 (2)
Stoich.:	A3B5C5 (2)
Weight, g/mol:	333.03644
ΔH_f, kcal/mol:	-219.47
Dipole, Da:	5.65
IP(EA), eV:	-9.68(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)-N-[(4-methoxyphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1OC)C(=O)O)C(=O)O

DOS

IR

Vibrations