Geometry & MOs

Info

ID:	430492
PubChem CID:	135170556
Reduced:	NO4C5H7 (1)
Stoich.:	AB4C5D7 (1)
Weight, g/mol:	151.110947
ΔH_f, kcal/mol:	-106.27
Dipole, Da:	3.75
IP(EA), eV:	-10.12(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclobutyl-1,5-dimethyl-1,2,4-triazole

Drug info:

PubChemData

Smile

COC1=CC(N(C1=O)O)O

DOS

IR

Vibrations