Geometry & MOs

Info

ID:	142367
PubChem CID:	53022197
Reduced:	ClO3N4C18H23 (1)
Stoich.:	AB3C4D18E23 (1)
Weight, g/mol:	462.19032
ΔH_f, kcal/mol:	-54.8
Dipole, Da:	6.84
IP(EA), eV:	-8.61(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4,5-trimethoxy-N-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]benzamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CCNC2=C(C(=NO2)C3=CC=C(C=C3)Cl)C(=O)OC

DOS

IR

Vibrations