Geometry & MOs

Info

ID:	373454
PubChem CID:	131315577
Reduced:	ON2H8C12 (1)
Stoich.:	AB2C8D12 (1)
Weight, g/mol:	196.063663
ΔH_f, kcal/mol:	34.08
Dipole, Da:	6.16
IP(EA), eV:	-9.59(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-hydroxyphenyl)pyridine-4-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC(=O)N2)C#N

DOS

IR

Vibrations