Geometry & MOs

Info

ID:	344098
PubChem CID:	127267274
Reduced:	SN2F3O3C12H13 (1)
Stoich.:	AB2C3D3E12F13 (1)
Weight, g/mol:	330.104956
ΔH_f, kcal/mol:	-260.47
Dipole, Da:	3.33
IP(EA), eV:	-9.85(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1,1-dioxothietan-3-yl)methyl]-3-(4-fluoro-2-propoxyphenyl)urea

Drug info:

PubChemData

Smile

C1C(CS1(=O)=O)CNC(=O)NC2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations