Geometry & MOs

Info

ID:	295969
PubChem CID:	117548732
Reduced:	OC7H9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	262.156895
ΔH_f, kcal/mol:	-69.17
Dipole, Da:	5.16
IP(EA), eV:	-9.17(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2-methoxy-5-propan-2-ylphenyl)oxetan-3-yl]propan-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2(COC2)CC(=O)C)C

DOS

IR

Vibrations