Geometry & MOs

Info

ID:	44612
PubChem CID:	10504394
Reduced:	SSiF3O6C19H25 (1)
Stoich.:	ABC3D6E19F25 (1)
Weight, g/mol:	466.156243
ΔH_f, kcal/mol:	-412.09
Dipole, Da:	4.16
IP(EA), eV:	-8.16(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 4-(4-methoxy-[1]benzothiolo[3,2-b]pyridin-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1=CC2=C(C=CC(=C2C=C1OS(=O)(=O)C(F)(F)F)OC)OC

DOS

IR

Vibrations