Geometry & MOs

Info

ID:

359638

PubChem CID:

127298912

Reduced:

O3N4C21H28 (1)

Stoich.:

A3B4C21D28 (1)

Weight, g/mol:

362.156575

ΔHf, kcal/mol:

-115.46

Dipole, Da:

5.89

IP(EA), eV:

-8.98(0.01)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

8-[4-(2,2,2-trifluoroethyl)piperazine-1-carbonyl]-1,3-diazaspiro[4.5]decane-2,4-dione

Drug info:

PubChemData

Smile

C1CN(CCN(C1)C(=O)C2CCC3(CC2)C(=O)NC(=O)N3)CC4=CC=CC=C4

DOS

IR

Vibrations