Geometry & MOs

Info

ID:	307491
PubChem CID:	125307139
Reduced:	O3N6C15H20 (1)
Stoich.:	A3B6C15D20 (1)
Weight, g/mol:	401.173942
ΔH_f, kcal/mol:	-37.11
Dipole, Da:	5.35
IP(EA), eV:	-9.18(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,3'aR,8'aS,8'bR)-2'-benzyl-5-methylspiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione

Drug info:

PubChemData

Smile

C1COCCN1C2=NC=C(C=N2)CN[C@H](CC3=NC=NC3)C(=O)O

DOS

IR

Vibrations