Geometry & MOs

Info

ID:	295965
PubChem CID:	117548706
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	234.125594
ΔH_f, kcal/mol:	-51.61
Dipole, Da:	5.72
IP(EA), eV:	-8.34(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(3-ethoxyphenyl)oxetan-3-yl]propan-2-one

Drug info:

PubChemData

Smile

CC(=O)CC1(COC1)C2=CC=C(C=C2)N(C)C

DOS

IR

Vibrations