Geometry & MOs

Info

ID:	44098
PubChem CID:	10500689
Reduced:	ClNH18C27 (1)
Stoich.:	ABC18D27 (1)
Weight, g/mol:	391.012661
ΔH_f, kcal/mol:	115.57
Dipole, Da:	2.11
IP(EA), eV:	-8.28(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2'-[(3,4-dichlorophenyl)methyl]spiro[pyrrolidine-3,4'-pyrrolo[1,2-a]pyrazine]-1',2,3',5-tetrone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C3C4=CC=CC=C4C(N3C5=CC=CC=C52)C6=CC=C(C=C6)Cl

DOS

IR

Vibrations