Geometry & MOs

Info

ID:	293097
PubChem CID:	117373870
Reduced:	O3C15H20 (1)
Stoich.:	A3B15C20 (1)
Weight, g/mol:	248.141244
ΔH_f, kcal/mol:	-127.72
Dipole, Da:	4.35
IP(EA), eV:	-9.11(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxy-3-propan-2-ylphenyl)cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC(=C1O)C2(CCC2)C(=O)O

DOS

IR

Vibrations