Geometry & MOs

Info

ID:	264528
PubChem CID:	103467701
Reduced:	N5C14H15 (1)
Stoich.:	A5B14C15 (1)
Weight, g/mol:	218.153147
ΔH_f, kcal/mol:	97.82
Dipole, Da:	7.56
IP(EA), eV:	-8.61(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-6-(2-methylpentan-3-ylamino)pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

CN(CCC1=CC=NC=C1)C2=NC(=C(C=C2)N)C#N

DOS

IR

Vibrations