Geometry & MOs

Info

ID:	228288
PubChem CID:	87563814
Reduced:	N2O4C17H32 (1)
Stoich.:	A2B4C17D32 (1)
Weight, g/mol:	664.061807
ΔH_f, kcal/mol:	-196.11
Dipole, Da:	1.91
IP(EA), eV:	-9.24(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dihydroxyphenyl)-7-[[2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-4-oxochromen-7-yl]oxy-methylphosphoryl]oxy-3,5-dihydroxychromen-4-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC[C@@H](C1CCCCC1)C(=O)N(C)OC

DOS

IR

Vibrations