Geometry & MOs

Info

ID:	143940
PubChem CID:	53284523
Reduced:	NO3C22H23 (1)
Stoich.:	AB3C22D23 (1)
Weight, g/mol:	342.126569
ΔH_f, kcal/mol:	-73.35
Dipole, Da:	3.43
IP(EA), eV:	-8.47(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,6-dichlorophenyl)methyl]-N-(2-methylpropyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(C(=O)NC1=CC=CC=C1OCC)OC2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations