Geometry & MOs

Info

ID:

365219

PubChem CID:

127317067

Reduced:

OSN4C20H28 (1)

Stoich.:

ABC4D20E28 (1)

Weight, g/mol:

266.174276

ΔHf, kcal/mol:

-11.48

Dipole, Da:

7.03

IP(EA), eV:

-8.71(-0.46)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)ethyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1CCC(=O)NC3=C(C4=C(S3)CCCC4)C#N

DOS

IR

Vibrations