Geometry & MOs

Info

ID:	151562
PubChem CID:	53837795
Reduced:	ClC5H7 (1)
Stoich.:	AB5C7 (1)
Weight, g/mol:	478.154015
ΔH_f, kcal/mol:	12.96
Dipole, Da:	2.09
IP(EA), eV:	-9.62(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-O-[2-(1,3-dioxoisoindol-2-yl)ethyl] 3-O-methyl 4-(3-fluorophenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

C=CC=CCCl

DOS

IR

Vibrations