Geometry & MOs

Info

ID:	63338
PubChem CID:	26750675
Reduced:	NO3C21H25 (1)
Stoich.:	AB3C21D25 (1)
Weight, g/mol:	323.152144
ΔH_f, kcal/mol:	-118.35
Dipole, Da:	2.44
IP(EA), eV:	-9.19(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 2-(4-phenylphenyl)acetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC(C)(C)C)OC(=O)CC1=CC=C(C=C1)C2=CC=CC=C2

DOS

IR

Vibrations