Geometry & MOs

Info

ID:	140603
PubChem CID:	52728861
Reduced:	FN2O2C18H27 (1)
Stoich.:	AB2C2D18E27 (1)
Weight, g/mol:	411.11575
ΔH_f, kcal/mol:	-130.09
Dipole, Da:	4.77
IP(EA), eV:	-8.98(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-bromoanilino)-2-oxoethyl]-N-(3-methoxypropyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC1=CC(=CC=C1)F)C(=O)CN2CCC(CC2)OCC

DOS

IR

Vibrations