Geometry & MOs

Info

ID:	291608
PubChem CID:	113447462
Reduced:	SN4C12H16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	251.126991
ΔH_f, kcal/mol:	57.2
Dipole, Da:	2.97
IP(EA), eV:	-8.57(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-aminopyridine-2-carbonyl)-ethylamino]butanoic acid

Drug info:

PubChemData

Smile

CCC(C1=NC=CS1)NCC2=C(C=CC=N2)N

DOS

IR

Vibrations