Geometry & MOs

Info

ID:	212528
PubChem CID:	81060851
Reduced:	N3C17H25 (1)
Stoich.:	A3B17C25 (1)
Weight, g/mol:	257.189198
ΔH_f, kcal/mol:	4.54
Dipole, Da:	5.32
IP(EA), eV:	-9.01(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-cyclohexylethylamino)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCC1CCC(CC1)CNC2=C(C(=NC(=C2)C)C)C#N

DOS

IR

Vibrations