Geometry & MOs

Info

ID:	295885
PubChem CID:	117546454
Reduced:	ON2C15H18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	231.162314
ΔH_f, kcal/mol:	10.58
Dipole, Da:	2.94
IP(EA), eV:	-8.48(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(2,5-dimethylphenyl)oxetan-3-yl]pyrrolidine

Drug info:

PubChemData

Smile

C1CNCC1C2(COC2)C3=CNC4=CC=CC=C43

DOS

IR

Vibrations