Geometry & MOs

Info

ID:

72587

PubChem CID:

48416333

Reduced:

SO3N4C15H22 (1)

Stoich.:

AB3C4D15E22 (1)

Weight, g/mol:

375.082367

ΔHf, kcal/mol:

-130.27

Dipole, Da:

6.4

IP(EA), eV:

-8.87(-0.29)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-[1-(5,9-dithia-1,7-diazatricyclo[6.3.0.02,6]undeca-2(6),3,7,10-tetraene-4-carbonyl)piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1=CSC(=O)N1CCC(=O)N2CCCC(C2)N3CCNC3=O

DOS

IR

Vibrations