Geometry & MOs

Info

ID:	402590
PubChem CID:	135056488
Reduced:	NO3C10H21 (1)
Stoich.:	AB3C10D21 (1)
Weight, g/mol:	220.005497
ΔH_f, kcal/mol:	-186.82
Dipole, Da:	3.49
IP(EA), eV:	-9.9(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-oxo-1,2-benzothiazole-5-carbonyl azide

Drug info:

PubChemData

Smile

C[C@H](C[C@@H](C)O)NC(=O)OC(C)(C)C

DOS

IR

Vibrations