Geometry & MOs

Info

ID:	175976
PubChem CID:	75977290
Reduced:	N2O4C17H24 (1)
Stoich.:	A2B4C17D24 (1)
Weight, g/mol:	306.140199
ΔH_f, kcal/mol:	-158.87
Dipole, Da:	3.13
IP(EA), eV:	-8.46(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(2-phenylsulfanylacetyl)piperidin-3-yl]propanamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)C(=O)N2CCCC(C2)CCC(=O)N

DOS

IR

Vibrations