Geometry & MOs

Info

ID:	46324
PubChem CID:	10523886
Reduced:	NO5C22H23 (1)
Stoich.:	AB5C22D23 (1)
Weight, g/mol:	381.168856
ΔH_f, kcal/mol:	-142.22
Dipole, Da:	4.48
IP(EA), eV:	-8.76(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dihydroxy-N-[5-[1-[4-(2-methylpropyl)phenyl]ethyl]-1,3,4-oxadiazol-2-yl]benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1C(CN=C1C2=CC=C(C=C2)OC)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations