Geometry & MOs

Info

ID:	212601
PubChem CID:	81061169
Reduced:	OSN3C14H15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	302.00548
ΔH_f, kcal/mol:	27.48
Dipole, Da:	2.24
IP(EA), eV:	-9.41(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)OCCC2=C(N=CS2)C

DOS

IR

Vibrations