Geometry & MOs

Info

ID:	236423
PubChem CID:	92712796
Reduced:	O6N9H19C23 (1)
Stoich.:	A6B9C19D23 (1)
Weight, g/mol:	382.12772
ΔH_f, kcal/mol:	72.17
Dipole, Da:	10.59
IP(EA), eV:	-9.19(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(2R)-3-acetyl-5-(4-nitrophenyl)-2H-1,3,4-oxadiazol-2-yl]methyl]-N-phenylacetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN([C@H](O2)C3=C(N(N=N3)C4=NON=C4NC(=O)C)C5=CC=C(C=C5)[N+](=O)[O-])C(=O)C

DOS

IR

Vibrations