Geometry & MOs

Info

ID:	295966
PubChem CID:	117548707
Reduced:	O3C14H18 (1)
Stoich.:	A3B14C18 (1)
Weight, g/mol:	250.120509
ΔH_f, kcal/mol:	-99.35
Dipole, Da:	5.6
IP(EA), eV:	-9.05(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(3,4-dimethoxyphenyl)oxetan-3-yl]propan-2-one

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C2(COC2)CC(=O)C

DOS

IR

Vibrations