Geometry & MOs

Info

ID:	260256
PubChem CID:	103186822
Reduced:	ClO2N3C9H12 (1)
Stoich.:	AB2C3D9E12 (1)
Weight, g/mol:	291.077454
ΔH_f, kcal/mol:	-47.53
Dipole, Da:	3.96
IP(EA), eV:	-9.94(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-methyl-N-(2-phenoxyethyl)pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

COCCCNC(=O)C1=CN=CC(=N1)Cl

DOS

IR

Vibrations