Geometry & MOs

Info

ID:	58371
PubChem CID:	24698066
Reduced:	NOBr2C11H13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	328.02227
ΔH_f, kcal/mol:	-38.79
Dipole, Da:	3.79
IP(EA), eV:	-9.2(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromo-2-fluorobenzoyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1=CC(=CC=C1)Br)Br

DOS

IR

Vibrations