Geometry & MOs

Info

ID:	298876
PubChem CID:	117662341
Reduced:	O5C15H18 (1)
Stoich.:	A5B15C18 (1)
Weight, g/mol:	419.173273
ΔH_f, kcal/mol:	-210.74
Dipole, Da:	1.91
IP(EA), eV:	-8.92(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-[[6-(4-methoxy-2,6-dimethylphenyl)pyridin-2-yl]oxymethyl]-2,3-dihydro-1-benzofuran-3-yl]acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)CC1COC2=C1C=CC(=C2)COC(=O)C

DOS

IR

Vibrations