Geometry & MOs

Info

ID:	84834
PubChem CID:	49870251
Reduced:	OS2H7N7C11 (1)
Stoich.:	AB2C7D7E11 (1)
Weight, g/mol:	316.020101
ΔH_f, kcal/mol:	132.51
Dipole, Da:	4.04
IP(EA), eV:	-8.94(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-8-(4-thiophen-2-yl-1,3-thiazol-2-yl)imidazo[5,1-d][1,2,3,5]tetrazin-4-one

Drug info:

PubChemData

Smile

CN1C(=O)N2C=NC(=C2N=N1)C3=NC(=CS3)C4=NC=CS4

DOS

IR

Vibrations