Geometry & MOs

Info

ID:	391377
PubChem CID:	135004586
Reduced:	ClSH9C10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	324.10888
ΔH_f, kcal/mol:	83.4
Dipole, Da:	1.46
IP(EA), eV:	-8.3(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-1-bromooct-1-enoxy]-4-propan-2-ylbenzene

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)SC(=C=C=C(Cl)Cl)SC2=C(C=CC(=C2)C)C

DOS

IR

Vibrations