Geometry & MOs

Info

ID:	248651
PubChem CID:	103083316
Reduced:	BrO2N3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	337.04259
ΔH_f, kcal/mol:	2.53
Dipole, Da:	2.9
IP(EA), eV:	-9.48(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(4-bromo-2-methylphenyl)-1,2,4-oxadiazol-5-yl]-4-methyloxolan-3-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)C2=NOC(=N2)C3COCC3NC

DOS

IR

Vibrations