Geometry & MOs

Info

ID:	225874
PubChem CID:	87235878
Reduced:	O5C13H14 (1)
Stoich.:	A5B13C14 (1)
Weight, g/mol:	569.257381
ΔH_f, kcal/mol:	-193.59
Dipole, Da:	2.96
IP(EA), eV:	-9.4(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butan-2-yloxy-[2-[formyl-[(E)-4-[6-methoxy-7-methyl-3-oxo-4-(2-trimethylsilylethoxy)-1H-2-benzofuran-5-yl]-2-methylbut-2-enyl]amino]ethyl]phosphinic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C=C(C(=C1C(=O)O)C)C=C)O

DOS

IR

Vibrations