Geometry & MOs

Info

ID:	302590
PubChem CID:	124385212
Reduced:	SN2C13H16 (1)
Stoich.:	AB2C13D16 (1)
Weight, g/mol:	606.019578
ΔH_f, kcal/mol:	36.59
Dipole, Da:	5.39
IP(EA), eV:	-8.14(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(2R)-2-[4-(carboxymethoxy)-2,3-dichlorobenzoyl]-2,5-diethyl-3,4-dihydropyran-6-yl]-2,3-dichlorophenoxy]acetic acid

Drug info:

PubChemData

Smile

C[C@H](CCN1C=CNC1=S)C2=CC=CC=C2

DOS

IR

Vibrations