Geometry & MOs

Info

ID:	163075
PubChem CID:	57588041
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	498.155764
ΔH_f, kcal/mol:	-79.23
Dipole, Da:	4.95
IP(EA), eV:	-9.3(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(4-chlorophenyl)-2-[(2-oxo-2-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylethyl)-prop-2-enoxycarbonylamino]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C(=O)N1CCC2(CC1)C3=CC=CC=C3CO2)N

DOS

IR

Vibrations