Geometry & MOs

Info

ID:	163066
PubChem CID:	57588028
Reduced:	ClN2O2C17H19 (1)
Stoich.:	AB2C2D17E19 (1)
Weight, g/mol:	428.150285
ΔH_f, kcal/mol:	-54.12
Dipole, Da:	3.59
IP(EA), eV:	-8.65(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-2-(4-chlorophenyl)-2-[(2-oxo-2-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylethyl)amino]acetate

Drug info:

PubChemData

Smile

CCOC(=O)CNC1=C(C=C(C=C1)Cl)C(C2=CC=CC=C2)N

DOS

IR

Vibrations