Geometry & MOs

Info

ID:	295964
PubChem CID:	117548694
Reduced:	O2C13H16 (1)
Stoich.:	A2B13C16 (1)
Weight, g/mol:	233.141579
ΔH_f, kcal/mol:	-61.26
Dipole, Da:	5.13
IP(EA), eV:	-9.39(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[4-(dimethylamino)phenyl]oxetan-3-yl]propan-2-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations