Geometry & MOs

Info

ID:	227454
PubChem CID:	87561785
Reduced:	NOC3H7 (2)
Stoich.:	ABC3D7 (2)
Weight, g/mol:	274.9654
ΔH_f, kcal/mol:	-107.66
Dipole, Da:	2.35
IP(EA), eV:	-9.14(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)tetrazol-2-yl] acetate

Drug info:

PubChemData

Smile

CC(CCOC(=O)N)NC

DOS

IR

Vibrations