Geometry & MOs

Info

ID:	301990
PubChem CID:	123107846
Reduced:	SO3C18H20 (1)
Stoich.:	AB3C18D20 (1)
Weight, g/mol:	366.070799
ΔH_f, kcal/mol:	-84.47
Dipole, Da:	3.64
IP(EA), eV:	-8.79(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-methyl-2-[[2-[(2-methylphenyl)methylsulfinyl]acetyl]amino]-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CS(=O)CC(=O)OCCC2=CC=CC=C2

DOS

IR

Vibrations