Geometry & MOs

Info

ID:	160603
PubChem CID:	57389182
Reduced:	SF3O3N6C7H7 (1)
Stoich.:	AB3C3D6E7F7 (1)
Weight, g/mol:	306.020495
ΔH_f, kcal/mol:	-173.88
Dipole, Da:	6.46
IP(EA), eV:	-10.14(-2.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-3-(methylsulfinylmethyl)-4-oxoimidazo[5,1-d][1,2,3,5]tetrazine-8-sulfonamide

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=C2N=NN(C(=O)N2C=N1)CC(F)(F)F

DOS

IR

Vibrations