Geometry & MOs

Info

ID:	262316
PubChem CID:	103284305
Reduced:	O2N3C12H21 (1)
Stoich.:	A2B3C12D21 (1)
Weight, g/mol:	222.136828
ΔH_f, kcal/mol:	-87.91
Dipole, Da:	4.2
IP(EA), eV:	-9.17(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpentyl 3-aminopyridine-4-carboxylate

Drug info:

PubChemData

Smile

CCCC(C)COC(=O)[C@@H](CC1=CN=CN1)N

DOS

IR

Vibrations