Geometry & MOs

Info

ID:	155548
PubChem CID:	56365884
Reduced:	SN3O3C26H33 (1)
Stoich.:	AB3C3D26E33 (1)
Weight, g/mol:	408.241293
ΔH_f, kcal/mol:	-104.09
Dipole, Da:	4.1
IP(EA), eV:	-8.49(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzoylpiperidin-4-yl)-2-(2,4-dimethylphenoxy)-N-propylacetamide

Drug info:

PubChemData

Smile

CCCN(C1CCN(CC1)C(=O)C2=CC=CC=C2)C(=O)CSCC(=O)NC3=CC=C(C=C3)C

DOS

IR

Vibrations