Geometry & MOs

Info

ID:	211577
PubChem CID:	81044500
Reduced:	BrFON2C15H20 (1)
Stoich.:	ABCD2E15F20 (1)
Weight, g/mol:	281.246713
ΔH_f, kcal/mol:	-93.66
Dipole, Da:	3.18
IP(EA), eV:	-9.13(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-piperidin-3-yl-N-(3-pyrrolidin-1-ylpropyl)butanamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=C(C=C(C=C1)F)Br)C2CCCNC2

DOS

IR

Vibrations