Geometry & MOs

Info

ID:	266885
PubChem CID:	103579872
Reduced:	FSN3H10C15 (1)
Stoich.:	ABC3D10E15 (1)
Weight, g/mol:	283.057947
ΔH_f, kcal/mol:	77.52
Dipole, Da:	5.62
IP(EA), eV:	-9.01(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-5-[(2-thiophen-2-ylimidazol-1-yl)methyl]benzonitrile

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)C#N)F)CN2C=CN=C2C3=CC=CS3

DOS

IR

Vibrations