Geometry & MOs

Info

ID:	341050
PubChem CID:	127263485
Reduced:	NO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	198.037147
ΔH_f, kcal/mol:	-77.76
Dipole, Da:	2.85
IP(EA), eV:	-8.41(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,6aS)-3a,6a-difluoro-2,3,5,6-tetrahydro-1H-pyrrolo[3,4-c]pyrrol-4-one;hydrochloride

Drug info:

PubChemData

Smile

CC1CC(=O)N(C2=C1C=C(C=C2)O)C

DOS

IR

Vibrations