Geometry & MOs

Info

ID:	29635
PubChem CID:	835939
Reduced:	NO2C20H25 (1)
Stoich.:	AB2C20D25 (1)
Weight, g/mol:	277.131408
ΔH_f, kcal/mol:	-73.92
Dipole, Da:	3.36
IP(EA), eV:	-8.93(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methylpiperidin-4-yl) 2-acetyloxybenzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=C(C=CC=C2C)C

DOS

IR

Vibrations