Geometry & MOs

Info

ID:	150597
PubChem CID:	53790290
Reduced:	O3N6C29H30 (1)
Stoich.:	A3B6C29D30 (1)
Weight, g/mol:	313.215413
ΔH_f, kcal/mol:	-2.57
Dipole, Da:	6.01
IP(EA), eV:	-8.79(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1',2-dimethyl-5-(2-methylphenyl)spiro[1,3a,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-4,4'-piperidine]-3-one

Drug info:

PubChemData

Smile

CC1=NC2=C(N1CC3CCN(CC3)C(=O)C4=CN(C5=CC=CC(=C54)C6=CC=CO6)C(=O)N(C)C)C=CN=C2

DOS

IR

Vibrations