Geometry & MOs

Info

ID:	304976
PubChem CID:	124766380
Reduced:	FN2O4C17H19 (1)
Stoich.:	AB2C4D17E19 (1)
Weight, g/mol:	368.137222
ΔH_f, kcal/mol:	-180.39
Dipole, Da:	0.4
IP(EA), eV:	-9.94(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC[C@]1([C@H]2[C@H]([C@H](N1)C3=CC=C(C=C3)F)C(=O)N(C2=O)C)C(=O)OC

DOS

IR

Vibrations