Geometry & MOs

Info

ID:	183442
PubChem CID:	77021772
Reduced:	SO2N3C11H15 (1)
Stoich.:	AB2C3D11E15 (1)
Weight, g/mol:	279.104148
ΔH_f, kcal/mol:	-18.12
Dipole, Da:	3.17
IP(EA), eV:	-8.65(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(N'-hydroxycarbamimidoyl)phenyl]-N-methylthiolane-3-carboxamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC(=C1)C(=NO)N)C(=O)CSC

DOS

IR

Vibrations