Geometry & MOs

Info

ID:	437476
PubChem CID:	135226401
Reduced:	SN2O4C10H10 (1)
Stoich.:	AB2C4D10E10 (1)
Weight, g/mol:	141.036068
ΔH_f, kcal/mol:	-98.25
Dipole, Da:	3.61
IP(EA), eV:	-9.32(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3a,6a-dihydro-1H-pyrazolo[4,3-d][1,3]thiazole

Drug info:

PubChemData

Smile

CC(=O)C1=NN(C2=CC=CC=C21)CS(=O)(=O)O

DOS

IR

Vibrations