Geometry & MOs

Info

ID:	252621
PubChem CID:	103112732
Reduced:	O3N5C11H15 (1)
Stoich.:	A3B5C11D15 (1)
Weight, g/mol:	282.132805
ΔH_f, kcal/mol:	-22.49
Dipole, Da:	3.52
IP(EA), eV:	-10.45(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 5-methyl-1-[(2-oxo-1,3-oxazolidin-5-yl)methyl]triazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(N=NN1CC2=NC=NO2)C(=O)OC(C)(C)C

DOS

IR

Vibrations