Geometry & MOs

Info

ID:	235820
PubChem CID:	92710725
Reduced:	SO2N6C18H28 (1)
Stoich.:	AB2C6D18E28 (1)
Weight, g/mol:	470.21001
ΔH_f, kcal/mol:	-47.32
Dipole, Da:	4.01
IP(EA), eV:	-8.12(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-[(3R)-3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl]-1,3,4-thiadiazol-2-yl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C(=O)[C@H]2CCCN(C2)C3=NN=C(S3)N4CCCC4=O

DOS

IR

Vibrations