Geometry & MOs

Info

ID:	212426
PubChem CID:	81060514
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	265.157898
ΔH_f, kcal/mol:	-63.05
Dipole, Da:	6.37
IP(EA), eV:	-9.26(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-(2,4,6-trimethylanilino)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)NC2CCCCCC2C(=O)O

DOS

IR

Vibrations