Geometry & MOs

Info

ID:	195851
PubChem CID:	78743199
Reduced:	NSO4C19H19 (1)
Stoich.:	ABC4D19E19 (1)
Weight, g/mol:	364.090449
ΔH_f, kcal/mol:	-105.1
Dipole, Da:	7.44
IP(EA), eV:	-8.56(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(ethylamino)-1-oxopropan-2-yl] 3-[(3,4-difluorophenyl)sulfonylamino]propanoate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C=CC(=O)OCC(=O)NC2=CC=CC=C2SC

DOS

IR

Vibrations