Geometry & MOs

Info

ID:	293844
PubChem CID:	117405084
Reduced:	O3C16H20 (1)
Stoich.:	A3B16C20 (1)
Weight, g/mol:	260.141245
ΔH_f, kcal/mol:	-105.91
Dipole, Da:	3.29
IP(EA), eV:	-9.41(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-3-[2-(2-methylprop-2-enoxy)phenyl]propanoic acid

Drug info:

PubChemData

Smile

CC(=C)COC1=CC=CC=C1C2(CCCC2)C(=O)O

DOS

IR

Vibrations