Geometry & MOs

Info

ID:	50400
PubChem CID:	12012931
Reduced:	N2O3H18C22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	358.131742
ΔH_f, kcal/mol:	1.6
Dipole, Da:	4.28
IP(EA), eV:	-9.02(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S,6aR)-2-ethyl-5-phenyl-6-(2-phenylethynyl)-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)C2C1=O)C3=CC=CC=C3)C#CC4=CC=CC=C4

DOS

IR

Vibrations