Geometry & MOs

Info

ID:	21267
PubChem CID:	587811
Reduced:	NOSCl2H7C12 (1)
Stoich.:	ABCD2E7F12 (1)
Weight, g/mol:	282.96254
ΔH_f, kcal/mol:	15.28
Dipole, Da:	4.13
IP(EA), eV:	-9.6(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-(2-chlorophenyl) 2-chloropyridine-3-carbothioate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)SC(=O)C2=C(N=CC=C2)Cl)Cl

DOS

IR

Vibrations