Geometry & MOs

Info

ID:	38748
PubChem CID:	8137863
Reduced:	SO2N3C21H23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	395.184506
ΔH_f, kcal/mol:	-40.31
Dipole, Da:	4.35
IP(EA), eV:	-8.92(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-N-[5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pentyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@@H](C)C(=O)N(C)C)C

DOS

IR

Vibrations