Geometry & MOs

Info

ID:	228177
PubChem CID:	87563602
Reduced:	SN3O3H11C14 (1)
Stoich.:	AB3C3D11E14 (1)
Weight, g/mol:	267.002386
ΔH_f, kcal/mol:	-49.21
Dipole, Da:	6.28
IP(EA), eV:	-9.06(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(benzenesulfonyl)-2-methyl-1,3-thiazole-5-carbaldehyde

Drug info:

PubChemData

Smile

COC1=C(C=CC=N1)C2=CC3=C(C=C2)N=C(S3)NC(=O)O

DOS

IR

Vibrations