Geometry & MOs

Info

ID:	211720
PubChem CID:	81050864
Reduced:	ON3C15H25 (1)
Stoich.:	AB3C15D25 (1)
Weight, g/mol:	307.939633
ΔH_f, kcal/mol:	-39.15
Dipole, Da:	1.25
IP(EA), eV:	-9.1(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)CN)N(C)CC2CCOCC2

DOS

IR

Vibrations