Geometry & MOs

Info

ID:	55418
PubChem CID:	17395367
Reduced:	OF3N4C15H21 (1)
Stoich.:	AB3C4D15E21 (1)
Weight, g/mol:	352.099397
ΔH_f, kcal/mol:	-188.93
Dipole, Da:	7.42
IP(EA), eV:	-8.81(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxyphenyl)-5-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)NC(=O)CN1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations