Geometry & MOs

Info

ID:	410712
PubChem CID:	135083513
Reduced:	NSO4C7H13 (1)
Stoich.:	ABC4D7E13 (1)
Weight, g/mol:	269.018036
ΔH_f, kcal/mol:	-157.81
Dipole, Da:	5.22
IP(EA), eV:	-10.32(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl 2,4-dimethyl-1,3-thiazole-5-sulfonate

Drug info:

PubChemData

Smile

COC(=O)[C@H](CC=C)CS(=O)(=O)N

DOS

IR

Vibrations