Geometry & MOs

Info

ID:	293887
PubChem CID:	117410111
Reduced:	O4C15H18 (1)
Stoich.:	A4B15C18 (1)
Weight, g/mol:	262.120509
ΔH_f, kcal/mol:	-139.19
Dipole, Da:	4.95
IP(EA), eV:	-8.77(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-3-(5-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)propanoic acid

Drug info:

PubChemData

Smile

CC1=C(C2=C(C=C1)OCCO2)C(CC(=O)O)C3CC3

DOS

IR

Vibrations