Geometry & MOs

Info

ID:	46523
PubChem CID:	10524983
Reduced:	OC10H18 (1)
Stoich.:	AB10C18 (1)
Weight, g/mol:	399.198048
ΔH_f, kcal/mol:	-61.93
Dipole, Da:	2.12
IP(EA), eV:	-10.04(2.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-2-pyridin-4-ylsulfanylacetamide

Drug info:

PubChemData

Smile

C[C@@H]1[C@H]2C[C@H](C2(C)C)C[C@H]1O

DOS

IR

Vibrations