Geometry & MOs

Info

ID:	55450
PubChem CID:	17395411
Reduced:	BrN2O3C15H15 (1)
Stoich.:	AB2C3D15E15 (1)
Weight, g/mol:	364.04226
ΔH_f, kcal/mol:	-66.78
Dipole, Da:	4.68
IP(EA), eV:	-9.06(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3,5-dimethoxy-N-(2-pyridin-2-ylethyl)benzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations