Geometry & MOs

Info

ID:	357567
PubChem CID:	127294230
Reduced:	NO3C18H21 (1)
Stoich.:	AB3C18D21 (1)
Weight, g/mol:	284.163711
ΔH_f, kcal/mol:	-88.88
Dipole, Da:	4.84
IP(EA), eV:	-8.81(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C3=C(O2)C=CC(=C3)OCC(=O)NC4CCC4

DOS

IR

Vibrations