Geometry & MOs

Info

ID:	206514
PubChem CID:	80263226
Reduced:	ClFO2H14C16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	268.048878
ΔH_f, kcal/mol:	-96.62
Dipole, Da:	3.58
IP(EA), eV:	-8.75(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[chloro-(2-fluoro-4-methylphenyl)methyl]-5-ethylthiophene

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C2=CC3=C(C=C2)OCCO3)Cl)F

DOS

IR

Vibrations