Geometry & MOs

Info

ID:	6865
PubChem CID:	70305
Reduced:	ClOSH7C8 (1)
Stoich.:	ABCD7E8 (1)
Weight, g/mol:	185.990614
ΔH_f, kcal/mol:	-1.11
Dipole, Da:	4.5
IP(EA), eV:	-9.3(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-(4-methylphenyl) chloromethanethioate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC(=S)Cl

DOS

IR

Vibrations