Geometry & MOs

Info

ID:	236445
PubChem CID:	92712999
Reduced:	SN3O3H19C22 (1)
Stoich.:	AB3C3D19E22 (1)
Weight, g/mol:	405.114713
ΔH_f, kcal/mol:	-22.14
Dipole, Da:	3.04
IP(EA), eV:	-8.79(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2S)-3-acetyl-5-thiophen-2-yl-2H-1,3,4-oxadiazol-2-yl]phenyl]-4-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)[C@H]3N(N=C(O3)C4=CC=CS4)C(=O)C

DOS

IR

Vibrations