Geometry & MOs

Info

ID:	168146
PubChem CID:	74930024
Reduced:	ClNO4C26H30 (1)
Stoich.:	ABC4D26E30 (1)
Weight, g/mol:	518.226431
ΔH_f, kcal/mol:	-146.85
Dipole, Da:	5.61
IP(EA), eV:	-8.79(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-O-tert-butyl 3-O,5-O-dimethyl 1-(1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)pyrrolidine-2,3,5-tricarboxylate

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1OC2CCCC2)CC(=O)NC3CC4(CCC4)OC5=C3C=CC=C5Cl

DOS

IR

Vibrations