Geometry & MOs

Info

ID:	24808
PubChem CID:	613806
Reduced:	NO2H9C14 (1)
Stoich.:	AB2C9D14 (1)
Weight, g/mol:	223.063329
ΔH_f, kcal/mol:	19.45
Dipole, Da:	3.94
IP(EA), eV:	-9.66(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-formylphenoxy)benzonitrile

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C=O)OC2=CC=C(C=C2)C#N

DOS

IR

Vibrations