Geometry & MOs

Info

ID:	43933
PubChem CID:	10322141
Reduced:	ClO6C25H31 (1)
Stoich.:	AB6C25D31 (1)
Weight, g/mol:	462.207406
ΔH_f, kcal/mol:	-252.13
Dipole, Da:	7.44
IP(EA), eV:	-8.47(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-chlorophenyl)-N-[4-methoxy-3-(1-propan-2-ylpiperidin-4-yl)phenyl]benzamide

Drug info:

PubChemData

Smile

CC[C@](C)(C(=O)O)OC1=CC=C(C=C1)OCCCOC2=C(C=C3CCC(OC3=C2)(C)C)Cl

DOS

IR

Vibrations