Geometry & MOs

Info

ID:	168172
PubChem CID:	74932693
Reduced:	NO3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	517.282823
ΔH_f, kcal/mol:	-118.03
Dipole, Da:	1.97
IP(EA), eV:	-8.2(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-hydroxyhexyl)-3,4,5-tris(phenylmethoxy)piperidin-2-one

Drug info:

PubChemData

Smile

CCCOC(CC1=CC=C(C=C1)N)C(=O)OC

DOS

IR

Vibrations