Geometry & MOs

Info

ID:

420377

PubChem CID:

135112817

Reduced:

ON6C14H22 (1)

Stoich.:

AB6C14D22 (1)

Weight, g/mol:

387.186815

ΔHf, kcal/mol:

1.42

Dipole, Da:

2.93

IP(EA), eV:

-8.5(0.34)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-methyl-9-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]-1-oxa-9-azaspiro[5.5]undecan-4-ol

Drug info:

PubChemData

Smile

CCN(C)C1=NC(=NC=C1)N2CCN3CCNC(=O)C3C2

DOS

IR

Vibrations