Geometry & MOs

Info

ID:	304664
PubChem CID:	124766032
Reduced:	N2O4C25H28 (1)
Stoich.:	A2B4C25D28 (1)
Weight, g/mol:	360.168522
ΔH_f, kcal/mol:	-123.0
Dipole, Da:	3.92
IP(EA), eV:	-9.07(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1S,3R,3aR,6aR)-3-ethyl-1-(4-methoxyphenyl)-5-methyl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate

Drug info:

PubChemData

Smile

CCC[C@]1([C@H]2[C@H]([C@H](N1)C3=CC=CC=C3C)C(=O)N(C2=O)C4=CC=CC=C4)C(=O)OCC

DOS

IR

Vibrations