Geometry & MOs

Info

ID:	338803
PubChem CID:	127259814
Reduced:	NO3C20H29 (1)
Stoich.:	AB3C20D29 (1)
Weight, g/mol:	409.157535
ΔH_f, kcal/mol:	-148.36
Dipole, Da:	1.13
IP(EA), eV:	-9.02(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-chloroethyl(methyl)amino]-2-phenylpentan-2-yl] 2-phenylacetate;hydrochloride

Drug info:

PubChemData

Smile

C1CCC(CC1)[C@H](N2CCC(CC2)OC(=O)CC3=CC=CC=C3)O

DOS

IR

Vibrations