Geometry & MOs

Info

ID:	276029
PubChem CID:	103820060
Reduced:	SN4C10H18 (1)
Stoich.:	AB4C10D18 (1)
Weight, g/mol:	226.125218
ΔH_f, kcal/mol:	22.76
Dipole, Da:	2.01
IP(EA), eV:	-8.61(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-methyl-3-N-(4-methylsulfanylbutan-2-yl)pyrazine-2,3-diamine

Drug info:

PubChemData

Smile

CCSCCC(C)NC1=NC=CN=C1N

DOS

IR

Vibrations