Geometry & MOs

Info

ID:	171467
PubChem CID:	75381157
Reduced:	ClN3O3C17H20 (1)
Stoich.:	AB3C3D17E20 (1)
Weight, g/mol:	298.225643
ΔH_f, kcal/mol:	-70.22
Dipole, Da:	3.34
IP(EA), eV:	-9.02(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]-3-hydroxypiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CNC(=O)N(CCO)C2CC2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations