Geometry & MOs

Info

ID:	285296
PubChem CID:	104098975
Reduced:	ON4C15H16 (1)
Stoich.:	AB4C15D16 (1)
Weight, g/mol:	248.127326
ΔH_f, kcal/mol:	57.45
Dipole, Da:	5.96
IP(EA), eV:	-8.76(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-6-[[2-(triazol-1-yl)ethylamino]methyl]phenol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC(=C2CNCCN3C=CN=N3)O

DOS

IR

Vibrations