Geometry & MOs

Info

ID:	244799
PubChem CID:	99381474
Reduced:	FSN3O4C17H22 (1)
Stoich.:	ABC3D4E17F22 (1)
Weight, g/mol:	363.05824
ΔH_f, kcal/mol:	-186.04
Dipole, Da:	3.94
IP(EA), eV:	-9.79(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2R)-1-(3-bromo-1H-indole-2-carbonyl)piperidin-2-yl]acetamide

Drug info:

PubChemData

Smile

C=CCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCCC[C@H]2CC(=O)N)F

DOS

IR

Vibrations