Geometry & MOs

Info

ID:	208267
PubChem CID:	80509305
Reduced:	ON4C14H22 (1)
Stoich.:	AB4C14D22 (1)
Weight, g/mol:	216.137497
ΔH_f, kcal/mol:	4.65
Dipole, Da:	1.23
IP(EA), eV:	-9.03(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methylcyclohexyl)amino]pyridazine-4-carbonitrile

Drug info:

PubChemData

Smile

CCC1=C(N=NC(=C1C#N)NCCCOCC)CC

DOS

IR

Vibrations