Geometry & MOs

Info

ID:	121726
PubChem CID:	50779110
Reduced:	O2N3C22H23 (1)
Stoich.:	A2B3C22D23 (1)
Weight, g/mol:	409.163771
ΔH_f, kcal/mol:	18.61
Dipole, Da:	1.58
IP(EA), eV:	-9.03(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[5-[(3,5-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl]phenyl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CCC1=CC=CC(=C1NC(=O)C2=CC=CC(=C2)C3=NOC(=N3)C4CCC4)C

DOS

IR

Vibrations