Geometry & MOs

Info

ID:	38689
PubChem CID:	8137640
Reduced:	SF2O2N3H17C19 (1)
Stoich.:	AB2C2D3E17F19 (1)
Weight, g/mol:	420.135508
ΔH_f, kcal/mol:	-113.09
Dipole, Da:	4.63
IP(EA), eV:	-9.22(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(ethylamino)-1-oxopropan-2-yl] 3-[(4-methoxyphenyl)-methylsulfamoyl]benzoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)N(C)C)SC1=NC2=CC=CC=C2C(=O)N1C3=C(C=C(C=C3)F)F

DOS

IR

Vibrations