Geometry & MOs

Info

ID:	87325
PubChem CID:	49894031
Reduced:	ClFNSO3H15C22 (1)
Stoich.:	ABCDE3F15G22 (1)
Weight, g/mol:	476.079055
ΔH_f, kcal/mol:	-91.11
Dipole, Da:	2.46
IP(EA), eV:	-9.07(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5Z)-5-[[4-(5-nitropyridin-2-yl)oxyphenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-phenylacetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=O)/C(=C/C3=CC=C(O3)C4=CC(=C(C=C4)F)Cl)/SC2=O

DOS

IR

Vibrations