Geometry & MOs

Info

ID:	287951
PubChem CID:	104302020
Reduced:	Cl2O2H14C15 (1)
Stoich.:	A2B2C14D15 (1)
Weight, g/mol:	315.93243
ΔH_f, kcal/mol:	-69.56
Dipole, Da:	4.08
IP(EA), eV:	-9.22(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromothiophen-2-yl)-(4-chloro-3-methylphenyl)methanol

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(C2=C(C=C(C=C2)OC)Cl)O)Cl

DOS

IR

Vibrations