Geometry & MOs

Info

ID:	212598
PubChem CID:	81061154
Reduced:	SN3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	259.168462
ΔH_f, kcal/mol:	45.7
Dipole, Da:	5.89
IP(EA), eV:	-8.43(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1)C2=C(C(=NC(=C2)C)C)C(=S)N

DOS

IR

Vibrations