Geometry & MOs

Info

ID:	171371
PubChem CID:	75368293
Reduced:	N3O4C15H15 (1)
Stoich.:	A3B4C15D15 (1)
Weight, g/mol:	330.169191
ΔH_f, kcal/mol:	-64.04
Dipole, Da:	8.45
IP(EA), eV:	-10.04(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-methyl-1-(4-methylphenyl)triazol-4-yl]-N-(oxan-2-yloxy)acetamide

Drug info:

PubChemData

Smile

C[C@H](C1=C(C(=NO1)C2=CN=CC=C2)C(=O)O)NC(=O)C3CC3

DOS

IR

Vibrations