Geometry & MOs

Info

ID:	35819
PubChem CID:	7980368
Reduced:	NO4C19H19 (1)
Stoich.:	AB4C19D19 (1)
Weight, g/mol:	381.053463
ΔH_f, kcal/mol:	-112.14
Dipole, Da:	4.12
IP(EA), eV:	-8.77(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[(1R)-1-(2,4-dichlorophenyl)ethyl]amino]-2-oxoethyl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

C[C@H]1CC2=CC=CC=C2N1C(=O)COC(=O)COC3=CC=CC=C3

DOS

IR

Vibrations