Geometry & MOs

Info

ID:	354081
PubChem CID:	127285885
Reduced:	ClN2O2C22H25 (1)
Stoich.:	AB2C2D22E25 (1)
Weight, g/mol:	384.160456
ΔH_f, kcal/mol:	-67.37
Dipole, Da:	2.59
IP(EA), eV:	-9.41(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide

Drug info:

PubChemData

Smile

C1CC2=C(C1NC(=O)C(C3=CC=CC=C3)N4CCC(CC4)O)C=CC=C2Cl

DOS

IR

Vibrations