Geometry & MOs

Info

ID:	275711
PubChem CID:	103817209
Reduced:	ClON4C10H11 (1)
Stoich.:	ABC4D10E11 (1)
Weight, g/mol:	295.069924
ΔH_f, kcal/mol:	28.62
Dipole, Da:	2.14
IP(EA), eV:	-10.02(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-5-chloro-N-(2,2,2-trifluoroethyl)pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CCCN(CC#N)C(=O)C1=CN=C(C=N1)Cl

DOS

IR

Vibrations