Geometry & MOs

Info

ID:	399295
PubChem CID:	135039467
Reduced:	INSO4C8H14 (1)
Stoich.:	ABCD4E8F14 (1)
Weight, g/mol:	269.108565
ΔH_f, kcal/mol:	-148.18
Dipole, Da:	2.36
IP(EA), eV:	-9.96(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[(1S)-1-phenylethyl]azetidin-2-yl]methyl methanesulfonate

Drug info:

PubChemData

Smile

COC(=O)/C=C/CN(CCI)S(=O)(=O)C

DOS

IR

Vibrations