Geometry & MOs

Info

ID:	277715
PubChem CID:	103830546
Reduced:	BrN2O2H13C14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	320.01604
ΔH_f, kcal/mol:	-21.97
Dipole, Da:	4.28
IP(EA), eV:	-9.37(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-hydroxy-N-[(6-methylpyridin-2-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=N1)C(=O)C2=CC(=C(C=C2)Br)O

DOS

IR

Vibrations