Geometry & MOs

Info

ID:	374667
PubChem CID:	131342375
Reduced:	NOC3H4 (2)
Stoich.:	ABC3D4 (2)
Weight, g/mol:	168.101111
ΔH_f, kcal/mol:	-48.72
Dipole, Da:	4.27
IP(EA), eV:	-10.21(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-methyl-2H-triazol-4-yl)morpholine

Drug info:

PubChemData

Smile

C1COC(=O)C(N1)CC#N

DOS

IR

Vibrations