Geometry & MOs

Info

ID:	170394
PubChem CID:	75227397
Reduced:	ON2H18C21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	578.383206
ΔH_f, kcal/mol:	60.77
Dipole, Da:	6.41
IP(EA), eV:	-8.28(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-[4-(4-tetradecoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,2,4-oxadiazolidin-5-one

Drug info:

PubChemData

Smile

C1C(NNC1=C2C=CC=CC2=O)C3=CC=CC=C3C4=CC=CC=C4

DOS

IR

Vibrations