Geometry & MOs

Info

ID:	302310
PubChem CID:	124361191
Reduced:	ClN4O4C23H25 (1)
Stoich.:	AB4C4D23E25 (1)
Weight, g/mol:	423.215806
ΔH_f, kcal/mol:	-143.23
Dipole, Da:	6.67
IP(EA), eV:	-8.55(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,3'R,5'R)-N-(2,5-dimethoxyphenyl)-5'-(2-methylpropyl)-2-oxospiro[1H-indole-3,2'-pyrrolidine]-3'-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC(=O)[C@]23[C@@H](C[C@@H](N3)CCC(=O)N)C(=O)NC4=C(C=CC(=C4)Cl)OC

DOS

IR

Vibrations