Geometry & MOs

Info

ID:	262358
PubChem CID:	103288150
Reduced:	ClSN2O2H11C15 (1)
Stoich.:	ABC2D2E11F15 (1)
Weight, g/mol:	316.959954
ΔH_f, kcal/mol:	-14.48
Dipole, Da:	4.48
IP(EA), eV:	-9.13(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dichloro-2-[(2-chlorophenyl)methylsulfanylmethyl]pyridine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CSC2=C(N3C=CC=CC3=N2)C(=O)O)Cl

DOS

IR

Vibrations