Geometry & MOs

Info

ID:	398136
PubChem CID:	135031967
Reduced:	OS2H16C17 (1)
Stoich.:	AB2C16D17 (1)
Weight, g/mol:	367.986313
ΔH_f, kcal/mol:	13.7
Dipole, Da:	0.88
IP(EA), eV:	-8.88(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[bis(5-methylthiophen-2-yl)methyl]-4,6-dichlorophenol

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(C2=CC=CC=C2O)C3=CC=C(S3)C

DOS

IR

Vibrations