Geometry & MOs

Info

ID:	136328
PubChem CID:	52023343
Reduced:	ClN2O2C13H15 (1)
Stoich.:	AB2C2D13E15 (1)
Weight, g/mol:	266.082205
ΔH_f, kcal/mol:	-69.22
Dipole, Da:	3.47
IP(EA), eV:	-8.66(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2R)-2-hydroxypropyl]-1-methylindole-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](CNC(=O)C1=CC2=C(N1C)C=CC=C2Cl)O

DOS

IR

Vibrations