Geometry & MOs

Info

ID:	21570
PubChem CID:	588941
Reduced:	SN5C10H15 (1)
Stoich.:	AB5C10D15 (1)
Weight, g/mol:	237.104817
ΔH_f, kcal/mol:	75.69
Dipole, Da:	2.38
IP(EA), eV:	-8.6(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-N'-[1-(3-methylpyrazin-2-yl)ethylideneamino]carbamimidothioic acid

Drug info:

PubChemData

Smile

CC1=NC=CN=C1C(=NN=C(N(C)C)S)C

DOS

IR

Vibrations