Geometry & MOs

Info

ID:	318808
PubChem CID:	126653363
Reduced:	FON2C10H11 (1)
Stoich.:	ABC2D10E11 (1)
Weight, g/mol:	321.137636
ΔH_f, kcal/mol:	-69.46
Dipole, Da:	6.54
IP(EA), eV:	-9.69(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(3S,4R)-4-(6-fluoro-2,3-dihydro-1-benzofuran-5-yl)-3-methyl-2-oxopyrrolidin-1-yl]acetate

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1)[C@H]2CC(=O)NC2)F

DOS

IR

Vibrations