Geometry & MOs

Info

ID:	203811
PubChem CID:	79873055
Reduced:	ClON3C14H20 (1)
Stoich.:	ABC3D14E20 (1)
Weight, g/mol:	247.168462
ΔH_f, kcal/mol:	-50.46
Dipole, Da:	5.9
IP(EA), eV:	-8.96(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCCC1NC(=O)C2=C(C=CC(=N2)N)Cl)C

DOS

IR

Vibrations