Geometry & MOs

Info

ID:	308280
PubChem CID:	125325622
Reduced:	N3O3H17C20 (1)
Stoich.:	A3B3C17D20 (1)
Weight, g/mol:	435.134969
ΔH_f, kcal/mol:	-25.0
Dipole, Da:	6.98
IP(EA), eV:	-8.77(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,3'aR,8'aS,8'bR)-2'-(3-chlorophenyl)-7-ethylspiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione

Drug info:

PubChemData

Smile

C[C@@H]1[C@@H](OC2=C(C1=O)C=CC=C2C(=O)NC3=NC=CN3)C4=CC=CC=C4

DOS

IR

Vibrations