Geometry & MOs

Info

ID:	63337
PubChem CID:	26750654
Reduced:	ClNO3H20C23 (1)
Stoich.:	ABC3D20E23 (1)
Weight, g/mol:	339.183444
ΔH_f, kcal/mol:	-72.48
Dipole, Da:	2.09
IP(EA), eV:	-9.1(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl] 2-(4-phenylphenyl)acetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC=CC=C1Cl)OC(=O)CC2=CC=C(C=C2)C3=CC=CC=C3

DOS

IR

Vibrations