Geometry & MOs

Info

ID:	56850
PubChem CID:	22394396
Reduced:	SCl2N2O3H10C17 (1)
Stoich.:	AB2C2D3E10F17 (1)
Weight, g/mol:	404.02337
ΔH_f, kcal/mol:	-1.14
Dipole, Da:	1.01
IP(EA), eV:	-9.14(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl]-6-hydroxy-5-methoxyindole-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1Cl)C=C(N2CC3=NOC(=C3)C4=CC=C(S4)Cl)C(=O)O

DOS

IR

Vibrations