Geometry & MOs

Info

ID:

306840

PubChem CID:

125258741

Reduced:

SO2N3C18H25 (1)

Stoich.:

AB2C3D18E25 (1)

Weight, g/mol:

157.110279

ΔHf, kcal/mol:

-72.27

Dipole, Da:

5.79

IP(EA), eV:

-8.9(-0.66)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3aS,6aS)-3a-(methoxymethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(=O)N2CC[C@H]3[C@@H]2CC(=O)N3CCN4CCCC4

DOS

IR

Vibrations