Geometry & MOs

Info

ID:	208082
PubChem CID:	80492825
Reduced:	NOC5H9 (2)
Stoich.:	ABC5D9 (2)
Weight, g/mol:	204.101111
ΔH_f, kcal/mol:	-74.93
Dipole, Da:	4.68
IP(EA), eV:	-9.37(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)oxetan-3-amine

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)CCNC2COC2

DOS

IR

Vibrations