Geometry & MOs

Info

ID:	131697
PubChem CID:	51247142
Reduced:	NSO4C19H23 (1)
Stoich.:	ABC4D19E23 (1)
Weight, g/mol:	317.088578
ΔH_f, kcal/mol:	-136.96
Dipole, Da:	4.92
IP(EA), eV:	-9.03(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-2-phenoxyacetamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1OCC(=O)NC(C)C2=CC=C(C=C2)S(=O)(=O)C

DOS

IR

Vibrations