Geometry & MOs

Info

ID:	337253
PubChem CID:	127256818
Reduced:	ICl2O3H9C15 (1)
Stoich.:	AB2C3D9E15 (1)
Weight, g/mol:	417.19738
ΔH_f, kcal/mol:	-64.59
Dipole, Da:	3.38
IP(EA), eV:	-9.56(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3,5-dimethylmorpholin-4-yl)-2-methyl-1,1-diphenylpropyl] methanesulfonate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C(=C\C2=CC(=C(C(=C2)Cl)O)Cl)/C(=O)O)I

DOS

IR

Vibrations