Geometry & MOs

Info

ID:	56452
PubChem CID:	17425497
Reduced:	SN2O3H14C17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	337.077265
ΔH_f, kcal/mol:	-14.83
Dipole, Da:	2.26
IP(EA), eV:	-8.79(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-benzyl-1,3-thiazol-4-yl)-6-methoxy-1-benzofuran-3-one

Drug info:

PubChemData

Smile

CC1=CN2C(=C(N=C2S1)C)/C=C/C(=O)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations