Geometry & MOs

Info

ID:	34042
PubChem CID:	7889568
Reduced:	NO3C22H27 (1)
Stoich.:	AB3C22D27 (1)
Weight, g/mol:	387.183444
ΔH_f, kcal/mol:	-115.61
Dipole, Da:	2.35
IP(EA), eV:	-8.79(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-oxo-1-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]propan-2-yl] 2-naphthalen-1-ylacetate

Drug info:

PubChemData

Smile

C[C@@H]1CCC[C@@H](N1C(=O)[C@@H](C)OC(=O)CC2=CC=CC3=CC=CC=C32)C

DOS

IR

Vibrations