Geometry & MOs

Info

ID:	330684
PubChem CID:	127248091
Reduced:	N3O3C20H29 (1)
Stoich.:	A3B3C20D29 (1)
Weight, g/mol:	327.215806
ΔH_f, kcal/mol:	-138.73
Dipole, Da:	3.05
IP(EA), eV:	-9.09(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[[3-hydroxy-1-(3-methoxypropanoyl)pyrrolidin-3-yl]methyl]piperidin-4-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)N2CCC(C2)(CN3CCC(CC3)NC(=O)C)O

DOS

IR

Vibrations