Geometry & MOs

Info

ID:	277923
PubChem CID:	103831926
Reduced:	ON5C15H23 (1)
Stoich.:	AB5C15D23 (1)
Weight, g/mol:	275.17461
ΔH_f, kcal/mol:	-6.54
Dipole, Da:	3.62
IP(EA), eV:	-8.58(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC1=CN=C2C(=C1)C=NN2C(C)C)N

DOS

IR

Vibrations