Geometry & MOs

Info

ID:	212644
PubChem CID:	81061295
Reduced:	N3O3C13H19 (1)
Stoich.:	A3B3C13D19 (1)
Weight, g/mol:	205.121512
ΔH_f, kcal/mol:	-135.18
Dipole, Da:	5.08
IP(EA), eV:	-9.74(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)(C(=O)O)NC1=C(C(=NC(=C1)C)C)C(=O)N

DOS

IR

Vibrations