Geometry & MOs

Info

ID:	212561
PubChem CID:	81060992
Reduced:	N3O4C14H19 (1)
Stoich.:	A3B4C14D19 (1)
Weight, g/mol:	251.142248
ΔH_f, kcal/mol:	-174.44
Dipole, Da:	3.46
IP(EA), eV:	-9.1(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(N-ethylanilino)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=O)N)NC2COCC2(C)C(=O)O

DOS

IR

Vibrations