Geometry & MOs

Info

ID:	270886
PubChem CID:	103638543
Reduced:	SN5H7C12 (1)
Stoich.:	AB5C7D12 (1)
Weight, g/mol:	262.125218
ΔH_f, kcal/mol:	138.85
Dipole, Da:	2.71
IP(EA), eV:	-9.09(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-ethyl-2-N-[(5-ethylthiophen-2-yl)methyl]pyrazine-2,6-diamine

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1NC3=NC=CN=C3C#N)SC=N2

DOS

IR

Vibrations