Geometry & MOs

Info

ID:	212248
PubChem CID:	81059931
Reduced:	ClON2H15C16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	252.126263
ΔH_f, kcal/mol:	7.61
Dipole, Da:	3.88
IP(EA), eV:	-9.51(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,5-dimethylphenoxy)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OC2=C(C(=NC(=C2)C)C)C#N)C)Cl

DOS

IR

Vibrations