Geometry & MOs

Info

ID:	145763
PubChem CID:	53589438
Reduced:	O2N3C20H25 (1)
Stoich.:	A2B3C20D25 (1)
Weight, g/mol:	294.159295
ΔH_f, kcal/mol:	-29.18
Dipole, Da:	2.83
IP(EA), eV:	-8.8(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(1,2,4-triazol-1-ylmethyl)piperidin-1-yl]quinoxaline

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)(C(=O)N2CCN(CC2)CC3=CC=CC=N3)OC

DOS

IR

Vibrations