Geometry & MOs

Info

ID:	296834
PubChem CID:	117595571
Reduced:	O2C11H14 (3)
Stoich.:	A2B11C14 (3)
Weight, g/mol:	542.190045
ΔH_f, kcal/mol:	-247.9
Dipole, Da:	7.66
IP(EA), eV:	-9.43(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;ethyl 2,4-dihydroxy-6-methylbenzoate

Drug info:

PubChemData

Smile

C1CC(C=C1)CCCCCCCCCCCCC(=O)O.C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O

DOS

IR

Vibrations