Geometry & MOs

Info

ID:	153065
PubChem CID:	56312190
Reduced:	SN2O4C23H32 (1)
Stoich.:	AB2C4D23E32 (1)
Weight, g/mol:	383.257277
ΔH_f, kcal/mol:	-128.82
Dipole, Da:	8.9
IP(EA), eV:	-8.75(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanocyclohexyl)-2-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]propanamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C1=CC=C(C=C1)OCCN2CCC(CC2)CC3=CC=C(C=C3)OC

DOS

IR

Vibrations