Geometry & MOs

Info

ID:	388249
PubChem CID:	134988650
Reduced:	Se3C11H14 (1)
Stoich.:	A3B11C14 (1)
Weight, g/mol:	230.134051
ΔH_f, kcal/mol:	32.52
Dipole, Da:	1.84
IP(EA), eV:	-8.18(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-methyl 4-methyl-3-oxodecanethioate

Drug info:

PubChemData

Smile

CC1C[Se]C([Se]C1)[Se]C2=CC=CC=C2

DOS

IR

Vibrations