Geometry & MOs

Info

ID:	323283
PubChem CID:	126673980
Reduced:	SF2Cl3O3N4H9C11 (1)
Stoich.:	AB2C3D3E4F9G11 (1)
Weight, g/mol:	540.158263
ΔH_f, kcal/mol:	-185.58
Dipole, Da:	2.49
IP(EA), eV:	-9.04(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-[[3-(2,6-dichlorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]methoxy]-N,2-dimethylanilino]methyl]cyclohexa-1,5-diene-1-carboxylic acid

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC(=C(C=C1Cl)Cl)N2C(=O)N(C(=N2)CCl)C(F)F

DOS

IR

Vibrations