Geometry & MOs

Info

ID:	341039
PubChem CID:	127263474
Reduced:	NO4C12H21 (1)
Stoich.:	AB4C12D21 (1)
Weight, g/mol:	239.08254
ΔH_f, kcal/mol:	-196.23
Dipole, Da:	1.64
IP(EA), eV:	-9.78(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2S)-1-phenylpropan-2-yl]-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine;hydrochloride

Drug info:

PubChemData

Smile

CCOC(=O)/C=C/CN(C)C(=O)OC(C)(C)C

DOS

IR

Vibrations