Geometry & MOs

Info

ID:	238870
PubChem CID:	93165644
Reduced:	N2O2C19H26 (1)
Stoich.:	A2B2C19D26 (1)
Weight, g/mol:	314.13972
ΔH_f, kcal/mol:	-53.44
Dipole, Da:	3.66
IP(EA), eV:	-8.56(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1R)-2-amino-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]ethyl]-2-chloro-6-methoxyphenol

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)[C@@H](CN)C2=C(C=CC3=CC=CC=C32)OC

DOS

IR

Vibrations