Geometry & MOs

Info

ID:	212351
PubChem CID:	81060245
Reduced:	N2C7H11 (2)
Stoich.:	A2B7C11 (2)
Weight, g/mol:	315.03711
ΔH_f, kcal/mol:	24.73
Dipole, Da:	6.19
IP(EA), eV:	-8.92(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-bromo-2-methylanilino)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCN(CC)CCNC1=C(C(=NC(=C1)C)C)C#N

DOS

IR

Vibrations