Geometry & MOs

Info

ID:	212287
PubChem CID:	81060017
Reduced:	ON4C13H16 (1)
Stoich.:	AB4C13D16 (1)
Weight, g/mol:	265.121512
ΔH_f, kcal/mol:	-10.42
Dipole, Da:	2.12
IP(EA), eV:	-9.44(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1-benzofuran-3-ylamino)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)NC2CCC(=O)NC2

DOS

IR

Vibrations