Geometry & MOs

Info

ID:	276675
PubChem CID:	103824665
Reduced:	Cl2O2N3C12H15 (1)
Stoich.:	A2B2C3D12E15 (1)
Weight, g/mol:	260.127326
ΔH_f, kcal/mol:	-80.63
Dipole, Da:	2.12
IP(EA), eV:	-9.75(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyano-N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=C(N=C(C=C1)Cl)Cl)C(=O)NC

DOS

IR

Vibrations