Geometry & MOs

Info

ID:	169284
PubChem CID:	75084412
Reduced:	N4O4C15H22 (1)
Stoich.:	A4B4C15D22 (1)
Weight, g/mol:	403.039355
ΔH_f, kcal/mol:	-131.74
Dipole, Da:	2.24
IP(EA), eV:	-9.05(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(benzenesulfonylmethyl)-1,3,4-oxadiazol-2-yl]-3-(2-chlorophenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CCC1(C2C(C3N1C(=NC)N(C3)C)C(=O)N(C2=O)C)C(=O)OC

DOS

IR

Vibrations