Geometry & MOs

Info

ID:	426139
PubChem CID:	135141074
Reduced:	IN2S3H7C11 (1)
Stoich.:	AB2C3D7E11 (1)
Weight, g/mol:	207.051799
ΔH_f, kcal/mol:	107.32
Dipole, Da:	3.33
IP(EA), eV:	-8.96(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluoro-5-methylthiophen-3-yl)-6-methylpyridine

Drug info:

PubChemData

Smile

CC1=CN=C(S1)C2=CC=C(S2)C3=NC=C(S3)I

DOS

IR

Vibrations