Geometry & MOs

Info

ID:	236983
PubChem CID:	92716600
Reduced:	NO2H11C13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	432.12407
ΔH_f, kcal/mol:	-62.88
Dipole, Da:	2.26
IP(EA), eV:	-8.39(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[(S)-(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethyl] 2-(1H-indol-3-yl)acetate

Drug info:

PubChemData

Smile

C1[C@H](N(C2=CC=CC=C2O1)C(=O)COC(=O)CC3=CNC4=CC=CC=C43)C5=CC=CC=C5

DOS

IR

Vibrations