Geometry & MOs

Info

ID:	308670
PubChem CID:	126522366
Reduced:	ClN2O3C18H21 (1)
Stoich.:	AB2C3D18E21 (1)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	-114.03
Dipole, Da:	3.57
IP(EA), eV:	-8.56(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl-[3-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CC(OC1)C(=O)N[C@@H]2C[C@@H](COC2)C3=CNC4=C3C=C(C=C4)Cl

DOS

IR

Vibrations