Geometry & MOs

Info

ID:	339148
PubChem CID:	127260527
Reduced:	O3H16C17 (1)
Stoich.:	A3B16C17 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-79.38
Dipole, Da:	4.72
IP(EA), eV:	-9.95(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-piperidin-1-ylbutyl benzoate

Drug info:

PubChemData

Smile

CCC(=O)C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2

DOS

IR

Vibrations