Geometry & MOs

Info

ID:	225951
PubChem CID:	87246472
Reduced:	ClN2O2C16H17 (1)
Stoich.:	AB2C2D16E17 (1)
Weight, g/mol:	271.008534
ΔH_f, kcal/mol:	-58.73
Dipole, Da:	2.77
IP(EA), eV:	-10.13(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methyl-2-pyrazin-2-yl-1,3-thiazol-4-yl) methanesulfonate

Drug info:

PubChemData

Smile

CC(C)(C)N(C1=CC=C(C=C1)C2=CC(=NC=C2)Cl)C(=O)O

DOS

IR

Vibrations