Geometry & MOs

Info

ID:	434337
PubChem CID:	135174704
Reduced:	FNO2C19H28 (1)
Stoich.:	ABC2D19E28 (1)
Weight, g/mol:	293.108565
ΔH_f, kcal/mol:	-137.87
Dipole, Da:	5.67
IP(EA), eV:	-9.17(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[5-[(2R)-1-(sulfanylamino)propan-2-yl]oxy-1-benzofuran-2-yl]propan-1-one

Drug info:

PubChemData

Smile

CCC(C)C(=O)CCC1=CC(=CC(=C1)F)OC2CC(C2)NCC

DOS

IR

Vibrations