Geometry & MOs

Info

ID:	123324
PubChem CID:	50842429
Reduced:	ON3C21H23 (1)
Stoich.:	AB3C21D23 (1)
Weight, g/mol:	402.169191
ΔH_f, kcal/mol:	4.15
Dipole, Da:	2.9
IP(EA), eV:	-7.97(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,4-dimethoxyphenyl)methyl]-4-(imidazo[4,5-b]pyridin-3-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)NC2=CC3=C(C=C2)NC4=C3CN(CC4)C)C

DOS

IR

Vibrations