Geometry & MOs

Info

ID:	144887
PubChem CID:	53428620
Reduced:	NO2C21H35 (1)
Stoich.:	AB2C21D35 (1)
Weight, g/mol:	347.282429
ΔH_f, kcal/mol:	-123.44
Dipole, Da:	0.58
IP(EA), eV:	-10.51(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,11,11-tetramethyldodecyl pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)CCCCCCCC(C)(C)COC(=O)C1=CN=CC=C1

DOS

IR

Vibrations