Geometry & MOs

Info

ID:	182511
PubChem CID:	76897838
Reduced:	S2O3N5C11H17 (1)
Stoich.:	A2B3C5D11E17 (1)
Weight, g/mol:	306.078662
ΔH_f, kcal/mol:	-92.34
Dipole, Da:	2.43
IP(EA), eV:	-8.92(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methyl-6-oxo-1,3-diazinan-2-yl)sulfanyl]imidazo[1,2-a]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=CC(=C(C=C1)SC2NC(CC(=O)N2)N)N

DOS

IR

Vibrations