Geometry & MOs

Info

ID:

351126

PubChem CID:

127279684

Reduced:

OS2N4C20H20 (1)

Stoich.:

AB2C4D20E20 (1)

Weight, g/mol:

336.150764

ΔHf, kcal/mol:

35.31

Dipole, Da:

3.43

IP(EA), eV:

-8.5(-0.97)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[1-(6,7-dihydro-4H-thieno[3,2-c]pyran-2-carbonyl)piperidin-4-yl]-2-methylpropanamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C2=C3C=CSC3=NC=N2)C(=O)NC4CCSC5=CC=CC=C45

DOS

IR

Vibrations