Geometry & MOs

Info

ID:	29702
PubChem CID:	836611
Reduced:	NO2H19C22 (1)
Stoich.:	AB2C19D22 (1)
Weight, g/mol:	344.141245
ΔH_f, kcal/mol:	-9.1
Dipole, Da:	3.6
IP(EA), eV:	-8.98(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methylphenyl) (2S)-2-(3-benzoylphenyl)propanoate

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3

DOS

IR

Vibrations