Geometry & MOs

Info

ID:	212452
PubChem CID:	81060579
Reduced:	ON3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	381.91394
ΔH_f, kcal/mol:	2.32
Dipole, Da:	4.15
IP(EA), eV:	-9.09(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,4-dibromophenoxy)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)OCCN(C)C

DOS

IR

Vibrations