Geometry & MOs

Info

ID:	355497
PubChem CID:	127288560
Reduced:	O2N4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	340.164774
ΔH_f, kcal/mol:	-65.84
Dipole, Da:	9.17
IP(EA), eV:	-9.39(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-ethyl-1,2,4-triazol-3-yl)piperidin-1-yl]-(3-methyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)methanone

Drug info:

PubChemData

Smile

CCN1C=NN=C1C2CCN(CC2)C(=O)C3CC4CCCC(C3)C4=O

DOS

IR

Vibrations