Geometry & MOs

Info

ID:	294259
PubChem CID:	117443924
Reduced:	NO5C14H15 (1)
Stoich.:	AB5C14D15 (1)
Weight, g/mol:	278.115424
ΔH_f, kcal/mol:	-118.01
Dipole, Da:	7.62
IP(EA), eV:	-8.71(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-methoxy-2-(oxetan-3-yloxy)phenyl]cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCC1=CC(=C(C(=C1)OC)OC)C2=NOC(=C2)C(=O)O

DOS

IR

Vibrations