Geometry & MOs

Info

ID:	212358
PubChem CID:	81060263
Reduced:	ON3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	303.041069
ΔH_f, kcal/mol:	-18.67
Dipole, Da:	5.1
IP(EA), eV:	-9.22(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-chloro-2-nitrophenoxy)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCCCN(CCO)C1=C(C(=NC(=C1)C)C)C#N

DOS

IR

Vibrations