Geometry & MOs

Info

ID:	297066
PubChem CID:	117607520
Reduced:	OF3N5C23H24 (1)
Stoich.:	AB3C5D23E24 (1)
Weight, g/mol:	154.05647
ΔH_f, kcal/mol:	-109.46
Dipole, Da:	10.17
IP(EA), eV:	-8.94(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NN3C=C(N=C3C=C2)C(=O)N4CCC(CC4)C5=CC=CC=C5C(F)(F)F

DOS

IR

Vibrations