Geometry & MOs

Info

ID:	236449
PubChem CID:	92713036
Reduced:	ClN2O3C20H21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	376.0171
ΔH_f, kcal/mol:	-67.95
Dipole, Da:	6.02
IP(EA), eV:	-8.91(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-5-(5-bromo-2-methoxyphenyl)-2-pyrazin-2-yl-2H-1,3,4-oxadiazol-3-yl]ethanone

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C2=NN([C@H](O2)COC3=CC=C(C=C3)Cl)C(=O)C

DOS

IR

Vibrations