Geometry & MOs

Info

ID:	32474
PubChem CID:	7837735
Reduced:	BrClNOC15H17 (1)
Stoich.:	ABCDE15F17 (1)
Weight, g/mol:	327.092915
ΔH_f, kcal/mol:	-39.37
Dipole, Da:	4.02
IP(EA), eV:	-9.06(-0.58)
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] 5-methylthiophene-2-carboxylate

Drug info:

PubChemData

Smile

C1C[C@H]2C[C@H]1C[C@H]2CC(=O)NC3=C(C=C(C=C3)Br)Cl

DOS

IR

Vibrations