Geometry & MOs

Info

ID:	262366
PubChem CID:	103288422
Reduced:	ClOSN2C16H17 (1)
Stoich.:	ABCD2E16F17 (1)
Weight, g/mol:	286.090662
ΔH_f, kcal/mol:	-10.55
Dipole, Da:	2.36
IP(EA), eV:	-8.61(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-chlorophenyl)methylsulfanyl]-N'-hydroxy-2,2-dimethylbutanimidamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CSCCC(=O)NC2=CC=CC=C2N)Cl

DOS

IR

Vibrations