Geometry & MOs

Info

ID:	13831
PubChem CID:	399255
Reduced:	S5H6C7 (1)
Stoich.:	A5B6C7 (1)
Weight, g/mol:	249.907306
ΔH_f, kcal/mol:	27.9
Dipole, Da:	4.24
IP(EA), eV:	-8.74(-2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-1,2,3,4,5-benzopentathiepine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)SSSSS2

DOS

IR

Vibrations