Geometry & MOs

Info

ID:	21266
PubChem CID:	587809
Reduced:	NCl2O2C17H23 (1)
Stoich.:	AB2C2D17E23 (1)
Weight, g/mol:	343.110584
ΔH_f, kcal/mol:	-102.65
Dipole, Da:	1.89
IP(EA), eV:	-8.76(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-ethyl-2-methylpiperidin-1-yl)ethyl 3,4-dichlorobenzoate

Drug info:

PubChemData

Smile

CCC1CCC(N(C1)CCOC(=O)C2=CC(=C(C=C2)Cl)Cl)C

DOS

IR

Vibrations