Geometry & MOs

Info

ID:	54699
PubChem CID:	17389121
Reduced:	ON3C14H15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	308.040168
ΔH_f, kcal/mol:	52.61
Dipole, Da:	6.74
IP(EA), eV:	-8.82(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(2-methoxy-5-methylsulfanylthiophen-3-yl)methylideneamino]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC\1=NC2=CC=CC=C2/C1=C\NNC(=O)C3CC3

DOS

IR

Vibrations