Geometry & MOs

Info

ID:	450
PubChem CID:	2780
Reduced:	ClO2N3C20H24 (1)
Stoich.:	AB2C3D20E24 (1)
Weight, g/mol:	373.155705
ΔH_f, kcal/mol:	-58.31
Dipole, Da:	6.14
IP(EA), eV:	-8.78(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(1-benzylpiperidin-4-yl)-5-chloro-2-methoxybenzamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl)N

DOS

IR

Vibrations