Geometry & MOs

Info

ID:	281073
PubChem CID:	103852779
Reduced:	BrNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	347.05209
ΔH_f, kcal/mol:	-38.96
Dipole, Da:	6.03
IP(EA), eV:	-8.78(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(3-methoxyphenyl)methyl]-N,3-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)N(C)CC2=CC=C(C=C2)OC)Br

DOS

IR

Vibrations