Geometry & MOs

Info

ID:

315003

PubChem CID:

126624158

Reduced:

SN4O4C30H44 (1)

Stoich.:

AB4C4D30E44 (1)

Weight, g/mol:

472.239579

ΔHf, kcal/mol:

-151.81

Dipole, Da:

6.39

IP(EA), eV:

 -7.96(-0.23)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 5-[1-(1,4-dioxaspiro[4.5]decan-8-yl)ethyl]-4-methyl-2-[2-[methyl-(6-methylpyridin-3-yl)amino]ethyl]thiophene-3-carboxylate

Drug info:

PubChemData

Smile

CCN(C1CCC(CC1)N2CC(C2)OCCOC)C3=C(C4=C(S3)CCN(C4=O)CC5=C(C=C(NC5=O)C)C)C

DOS

IR

Vibrations