Geometry & MOs

Info

ID:	24112
PubChem CID:	607891
Reduced:	O2S2C11H12 (2)
Stoich.:	A2B2C11D12 (2)
Weight, g/mol:	480.055744
ΔH_f, kcal/mol:	-140.67
Dipole, Da:	8.0
IP(EA), eV:	-8.83(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-[[4,5,8-tris(acetylsulfanylmethyl)naphthalen-1-yl]methyl] ethanethioate

Drug info:

PubChemData

Smile

CC(=O)SCC1=C2C(=CC=C(C2=C(C=C1)CSC(=O)C)CSC(=O)C)CSC(=O)C

DOS

IR

Vibrations