Geometry & MOs

Info

ID:	34054
PubChem CID:	7889630
Reduced:	NO2C6H7 (3)
Stoich.:	AB2C6D7 (3)
Weight, g/mol:	364.142307
ΔH_f, kcal/mol:	-235.24
Dipole, Da:	7.48
IP(EA), eV:	-9.64(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl] 2-benzamidoacetate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)N[C@H]1C)COC(=O)CNC(=O)C2=CC=CC=C2

DOS

IR

Vibrations