Geometry & MOs

Info

ID:	391876
PubChem CID:	135010499
Reduced:	SiO5C28H42 (1)
Stoich.:	AB5C28D42 (1)
Weight, g/mol:	318.157957
ΔH_f, kcal/mol:	-253.34
Dipole, Da:	3.79
IP(EA), eV:	-8.77(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl (3R)-3-benzyl-3,6-dihydropyridazine-1,2-dicarboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1[C@H]([C@@H]([C@H](C1=O)C)O[Si](C)(C)C(C)(C)C)[C@@H]2[C@H]([C@@H]3[C@H]4C[C@@H]([C@@H]3C2=O)C=C4)C(=C)C

DOS

IR

Vibrations