Geometry & MOs

Info

ID:	244808
PubChem CID:	99381483
Reduced:	Cl2O2N3C16H17 (1)
Stoich.:	A2B2C3D16E17 (1)
Weight, g/mol:	353.069782
ΔH_f, kcal/mol:	-77.43
Dipole, Da:	3.36
IP(EA), eV:	-8.92(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S)-1-(3,5-dichloro-1H-indole-2-carbonyl)piperidin-2-yl]acetamide

Drug info:

PubChemData

Smile

C1CCN([C@H](C1)CC(=O)N)C(=O)C2=C(C3=C(N2)C=CC(=C3)Cl)Cl

DOS

IR

Vibrations