Geometry & MOs

Info

ID:	250990
PubChem CID:	103100635
Reduced:	ClS2N3O3C10H16 (1)
Stoich.:	AB2C3D3E10F16 (1)
Weight, g/mol:	337.032161
ΔH_f, kcal/mol:	-67.26
Dipole, Da:	5.19
IP(EA), eV:	-8.76(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-4-methylthiophen-2-yl)sulfonyl-N'-hydroxypiperidine-2-carboximidamide

Drug info:

PubChemData

Smile

CCN(CCC(=NO)N)S(=O)(=O)C1=CC(=C(S1)Cl)C

DOS

IR

Vibrations