Geometry & MOs

Info

ID:	285919
PubChem CID:	104137762
Reduced:	O2N3C15H21 (1)
Stoich.:	A2B3C15D21 (1)
Weight, g/mol:	296.173607
ΔH_f, kcal/mol:	-55.12
Dipole, Da:	2.97
IP(EA), eV:	-9.02(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-6-[(2-hydroxy-3-methoxypropyl)-methylamino]pyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCN(CC(C)C#N)C1=CC(=CC(=N1)C(C)C)C(=O)O

DOS

IR

Vibrations