Geometry & MOs

Info

ID:	340496
PubChem CID:	127262507
Reduced:	NF2O2H17C18 (1)
Stoich.:	AB2C2D17E18 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-145.01
Dipole, Da:	5.36
IP(EA), eV:	-9.28(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-butylphenyl) piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)OC2=CC=C(C=C2)C3=CC(=CC(=C3)F)F

DOS

IR

Vibrations