Geometry & MOs

Info

ID:	297156
PubChem CID:	117610565
Reduced:	O2N5C8H9 (1)
Stoich.:	A2B5C8D9 (1)
Weight, g/mol:	176.038591
ΔH_f, kcal/mol:	29.69
Dipole, Da:	5.86
IP(EA), eV:	-10.21(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-methoxybenzene-1,3-dicarbonitrile

Drug info:

PubChemData

Smile

COC1=CC(=NC=C1CO)N2C=NN=N2

DOS

IR

Vibrations