Geometry & MOs

Info

ID:	201488
PubChem CID:	79544143
Reduced:	N2C15H28 (1)
Stoich.:	A2B15C28 (1)
Weight, g/mol:	262.057612
ΔH_f, kcal/mol:	-40.46
Dipole, Da:	2.63
IP(EA), eV:	-8.76(2.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]benzonitrile

Drug info:

PubChemData

Smile

CC1CCCC1NC2CCCC2C3CCCN3

DOS

IR

Vibrations