Geometry & MOs

Info

ID:	50396
PubChem CID:	12012926
Reduced:	BrF2N2O3C19H21 (1)
Stoich.:	AB2C2D3E19F21 (1)
Weight, g/mol:	334.131742
ΔH_f, kcal/mol:	-186.52
Dipole, Da:	4.24
IP(EA), eV:	-9.78(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S,6aR)-2-ethyl-5,6-diphenyl-6,6a-dihydro-3aH-pyrrolo[3,4-c]pyrrole-1,3,4-trione

Drug info:

PubChemData

Smile

CCN1C(=O)[C@H]2[C@H](N(C(=O)C2(C1=O)C(F)(F)Br)C(C)(C)C)C3=CC=CC=C3

DOS

IR

Vibrations