Geometry & MOs

Info

ID:	34197
PubChem CID:	7890251
Reduced:	Cl2O3H10C14 (1)
Stoich.:	A2B3C10D14 (1)
Weight, g/mol:	399.147058
ΔH_f, kcal/mol:	-95.2
Dipole, Da:	2.24
IP(EA), eV:	-9.54(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenylethyl] 3-hydroxybenzoate

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)O)C(=O)OCC2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations