Geometry & MOs

Info

ID:	139993
PubChem CID:	52627810
Reduced:	ClNOC8H8 (2)
Stoich.:	ABCD8E8 (2)
Weight, g/mol:	372.204907
ΔH_f, kcal/mol:	-59.78
Dipole, Da:	3.27
IP(EA), eV:	-9.31(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butoxy-3-methoxy-N-[(2-propan-2-yloxypyridin-3-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=CC=N1)CNC(=O)C2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations