Geometry & MOs

Info

ID:	275695
PubChem CID:	103817142
Reduced:	ClON3C11H14 (1)
Stoich.:	ABC3D11E14 (1)
Weight, g/mol:	290.093439
ΔH_f, kcal/mol:	3.85
Dipole, Da:	4.18
IP(EA), eV:	-9.66(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[3-[(dimethylamino)methyl]phenyl]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=C)C)C(=O)C1=CN=C(C=N1)Cl

DOS

IR

Vibrations