Geometry & MOs

Info

ID:	32580
PubChem CID:	7846032
Reduced:	ClNO4C21H22 (1)
Stoich.:	ABC4D21E22 (1)
Weight, g/mol:	387.123736
ΔH_f, kcal/mol:	-142.44
Dipole, Da:	3.88
IP(EA), eV:	-8.73(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-1-oxopropan-2-yl] 2-(4-chloro-3-methylphenoxy)acetate

Drug info:

PubChemData

Smile

C[C@@H]1CC2=CC=CC=C2N1C(=O)[C@H](C)OC(=O)COC3=CC(=C(C=C3)Cl)C

DOS

IR

Vibrations