Geometry & MOs

Info

ID:	212555
PubChem CID:	81060964
Reduced:	ON5C13H13 (1)
Stoich.:	AB5C13D13 (1)
Weight, g/mol:	244.157563
ΔH_f, kcal/mol:	54.6
Dipole, Da:	5.67
IP(EA), eV:	-9.67(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-(4-methylcyclohexyl)oxypyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)N2C=CC(=N2)C(=O)NC

DOS

IR

Vibrations