Geometry & MOs

Info

ID:	293255
PubChem CID:	117378998
Reduced:	O2C7H9 (2)
Stoich.:	A2B7C9 (2)
Weight, g/mol:	250.120509
ΔH_f, kcal/mol:	-144.01
Dipole, Da:	5.27
IP(EA), eV:	-9.58(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dimethoxy-6-methylphenyl)cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

COCC1=C(C(=CC=C1)OC)C2(CCC2)C(=O)O

DOS

IR

Vibrations