Geometry & MOs

Info

ID:	69009
PubChem CID:	46515442
Reduced:	N2O3C25H36 (1)
Stoich.:	A2B3C25D36 (1)
Weight, g/mol:	416.18667
ΔH_f, kcal/mol:	-103.61
Dipole, Da:	1.98
IP(EA), eV:	-8.62(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[1-(4-chlorophenyl)ethoxy]-2-hydroxypropyl]-N-phenylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C)C)OCC(CN(C)CC2=CC=CC=C2N3CCOCC3)O

DOS

IR

Vibrations