Geometry & MOs

Info

ID:	236378
PubChem CID:	92712598
Reduced:	N2O3C19H20 (1)
Stoich.:	A2B3C19D20 (1)
Weight, g/mol:	416.07356
ΔH_f, kcal/mol:	-51.6
Dipole, Da:	2.63
IP(EA), eV:	-8.88(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-5-[(4-bromophenoxy)methyl]-2-(4-propan-2-ylphenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@H]2N(N=C(O2)COC3=CC=CC=C3C)C(=O)C

DOS

IR

Vibrations