Geometry & MOs

Info

ID:	394014
PubChem CID:	135022170
Reduced:	OF3H13C18 (1)
Stoich.:	AB3C13D18 (1)
Weight, g/mol:	382.061671
ΔH_f, kcal/mol:	-141.81
Dipole, Da:	4.72
IP(EA), eV:	-9.12(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2,2-bis[(4-methylphenyl)sulfanyl]ethenyl]-3-chlorobenzene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2[C@@H](C3=CC(=CC=C3)C(F)(F)F)O

DOS

IR

Vibrations