Geometry & MOs

Info

ID:	212592
PubChem CID:	81061123
Reduced:	N3C13H19 (1)
Stoich.:	A3B13C19 (1)
Weight, g/mol:	380.92992
ΔH_f, kcal/mol:	13.09
Dipole, Da:	5.26
IP(EA), eV:	-8.94(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations