Geometry & MOs

Info

ID:	305441
PubChem CID:	124807262
Reduced:	FN2O2C19H25 (1)
Stoich.:	AB2C2D19E25 (1)
Weight, g/mol:	330.120213
ΔH_f, kcal/mol:	-123.0
Dipole, Da:	3.28
IP(EA), eV:	-9.16(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,6aR)-5-[(3-fluorophenyl)methyl]-2-(thiophen-3-ylmethyl)-3,3a,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrol-4-one

Drug info:

PubChemData

Smile

C1COCCC1CN2C[C@@H]3CN(C(=O)[C@@H]3C2)CC4=CC(=CC=C4)F

DOS

IR

Vibrations