Geometry & MOs

Info

ID:	179120
PubChem CID:	76436942
Reduced:	N3O4C19H25 (1)
Stoich.:	A3B4C19D25 (1)
Weight, g/mol:	328.103477
ΔH_f, kcal/mol:	-158.28
Dipole, Da:	3.47
IP(EA), eV:	-10.07(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-oxo-5-[[3-(trifluoromethyl)phenyl]methyl]-2,3,4,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole-3a-carboxylic acid

Drug info:

PubChemData

Smile

CCCC1=NC=CC(=C1)C(=O)N2CC3C(=O)N(CC3(C2)C(=O)O)CCC

DOS

IR

Vibrations