Geometry & MOs

Info

ID:	260949
PubChem CID:	103210577
Reduced:	ClO2F3C13H16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	367.86902
ΔH_f, kcal/mol:	-249.47
Dipole, Da:	6.91
IP(EA), eV:	-9.06(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[chloro-(3-chloro-4-iodophenyl)methyl]thiophene

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC)C(CCOCC(F)(F)F)Cl

DOS

IR

Vibrations