Geometry & MOs

Info

ID:	283318
PubChem CID:	103973818
Reduced:	O5C16H20 (1)
Stoich.:	A5B16C20 (1)
Weight, g/mol:	272.086015
ΔH_f, kcal/mol:	-214.09
Dipole, Da:	6.55
IP(EA), eV:	-8.89(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,3-difluorophenyl)methyl]-3-ethoxy-2-methyl-3-oxopropanoic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(C)(CC1CC2=C(O1)C=CC(=C2)C)C(=O)O

DOS

IR

Vibrations