Geometry & MOs

Info

ID:	2330
PubChem CID:	6846
Reduced:	NH7C11 (1)
Stoich.:	AB7C11 (1)
Weight, g/mol:	153.057849
ΔH_f, kcal/mol:	71.96
Dipole, Da:	4.13
IP(EA), eV:	-9.33(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

naphthalene-1-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2C#N

DOS

IR

Vibrations