Geometry & MOs

Info

ID:	374199
PubChem CID:	131325327
Reduced:	ClFN2H6C11 (1)
Stoich.:	ABC2D6E11 (1)
Weight, g/mol:	232.055801
ΔH_f, kcal/mol:	22.8
Dipole, Da:	3.92
IP(EA), eV:	-9.7(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxyphenyl)-4-methylthiophene-2-carbaldehyde

Drug info:

PubChemData

Smile

C1=CC2=C(C=C(N=C2C(=C1)F)CC#N)Cl

DOS

IR

Vibrations