Geometry & MOs

Info

ID:	183435
PubChem CID:	77021601
Reduced:	SO2N3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	283.079076
ΔH_f, kcal/mol:	-25.87
Dipole, Da:	2.41
IP(EA), eV:	-8.89(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-fluoro-3-(N'-hydroxycarbamimidoyl)phenyl]thiolane-2-carboxamide

Drug info:

PubChemData

Smile

C1CSCC1C(=O)NC(C2=CC=CC=C2)C(=NO)N

DOS

IR

Vibrations