Geometry & MOs

Info

ID:	285925
PubChem CID:	104138015
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	234.136828
ΔH_f, kcal/mol:	-76.8
Dipole, Da:	4.64
IP(EA), eV:	-8.68(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclobutylamino)-6-propan-2-ylpyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCCN(CCN(C)C)C1=CC(=CC(=N1)CC)C(=O)O

DOS

IR

Vibrations