Geometry & MOs

Info

ID:	212313
PubChem CID:	81060094
Reduced:	ON4C13H18 (1)
Stoich.:	AB4C13D18 (1)
Weight, g/mol:	285.129969
ΔH_f, kcal/mol:	-8.81
Dipole, Da:	5.34
IP(EA), eV:	-9.46(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[(2-methyl-1-thiophen-2-ylpropyl)amino]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations