Geometry & MOs

Info

ID:	155579
PubChem CID:	56366008
Reduced:	SN3O5C24H31 (1)
Stoich.:	AB3C5D24E31 (1)
Weight, g/mol:	436.272593
ΔH_f, kcal/mol:	-136.37
Dipole, Da:	2.71
IP(EA), eV:	-9.15(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzoylpiperidin-4-yl)-2-(3-methyl-4-propan-2-ylphenoxy)-N-propylacetamide

Drug info:

PubChemData

Smile

CCCN(C1CCN(CC1)C(=O)C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N(C)OC

DOS

IR

Vibrations