Geometry & MOs

Info

ID:	277714
PubChem CID:	103830545
Reduced:	BrN2O2C15H21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	320.01604
ΔH_f, kcal/mol:	-73.62
Dipole, Da:	2.84
IP(EA), eV:	-8.8(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-hydroxy-N-methyl-N-(pyridin-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=CC(=C(C=C1)Br)O)CN2CCCC2

DOS

IR

Vibrations