Geometry & MOs

Info

ID:	87767
PubChem CID:	49897153
Reduced:	SN2O5H24C27 (1)
Stoich.:	AB2C5D24E27 (1)
Weight, g/mol:	468.05467
ΔH_f, kcal/mol:	-119.81
Dipole, Da:	9.62
IP(EA), eV:	-8.77(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5Z)-5-[[5-(3-chloro-4-methoxyphenyl)furan-2-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-phenylacetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OCCOC2=CC=CC=C2/C=C\3/C(=O)N(C(=O)S3)CC(=O)NC4=CC=CC=C4

DOS

IR

Vibrations