Geometry & MOs

Info

ID:	230744
PubChem CID:	87571858
Reduced:	F2N2O8C23H32 (1)
Stoich.:	A2B2C8D23E32 (1)
Weight, g/mol:	518.241812
ΔH_f, kcal/mol:	-414.9
Dipole, Da:	4.04
IP(EA), eV:	-8.87(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dibutyltin(2+);2-(3-ethyloctan-3-yl)hexanedioate

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C(C)C)O[C@]2([C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)CC3=C(C(=C(C=C3)OC(C)C)F)F

DOS

IR

Vibrations