Geometry & MOs

Info

ID:	388357
PubChem CID:	134988895
Reduced:	F3O3C9H17 (1)
Stoich.:	A3B3C9D17 (1)
Weight, g/mol:	225.994464
ΔH_f, kcal/mol:	-311.58
Dipole, Da:	3.91
IP(EA), eV:	-10.31(1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethanethioyl 4-methylbenzenecarbodithioate

Drug info:

PubChemData

Smile

CC(C)(C)C(C(OC)OC)(C(F)(F)F)O

DOS

IR

Vibrations