Geometry & MOs

Info

ID:	327104
PubChem CID:	126689004
Reduced:	NO2C15H19 (1)
Stoich.:	AB2C15D19 (1)
Weight, g/mol:	245.141579
ΔH_f, kcal/mol:	-63.54
Dipole, Da:	3.1
IP(EA), eV:	-9.09(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-propan-2-ylphenyl) 1,2,3,4-tetrahydropyridine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC=C1OC(=O)C2CCCC=N2

DOS

IR

Vibrations