Geometry & MOs

Info

ID:	136019
PubChem CID:	51966891
Reduced:	FSN3O4C17H24 (1)
Stoich.:	ABC3D4E17F24 (1)
Weight, g/mol:	479.174416
ΔH_f, kcal/mol:	-206.49
Dipole, Da:	4.64
IP(EA), eV:	-9.34(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-4-(2,3-dihydro-1-benzofuran-5-yl)-3-(4-fluorophenoxy)-1-[(3,4,5-trimethoxyphenyl)methyl]azetidin-2-one

Drug info:

PubChemData

Smile

CC[C@@H](C)C(=O)NCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2F

DOS

IR

Vibrations