Geometry & MOs

Info

ID:	225988
PubChem CID:	87246548
Reduced:	OPC16H17 (2)
Stoich.:	ABC16D17 (2)
Weight, g/mol:	284.028935
ΔH_f, kcal/mol:	-48.26
Dipole, Da:	7.35
IP(EA), eV:	-9.5(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-methyl-2-(6-methylpyridin-3-yl)-1,3-thiazol-4-yl] methanesulfonate

Drug info:

PubChemData

Smile

CC(C)(C1CCC1)C(P(=O)(C2=CC=CC=C2)C3=CC=CC=C3)P(=O)(C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations