Geometry & MOs

Info

ID:	70579
PubChem CID:	48413544
Reduced:	ON2C6H10 (3)
Stoich.:	AB2C6D10 (3)
Weight, g/mol:	391.263506
ΔH_f, kcal/mol:	-116.23
Dipole, Da:	5.25
IP(EA), eV:	-8.61(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(diethylamino)pentan-2-yl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC(=O)CN1C(=O)C2=C(N=CN2C)N(C1=O)C

DOS

IR

Vibrations