Geometry & MOs

Info

ID:	307210
PubChem CID:	125292398
Reduced:	O3N4C20H26 (1)
Stoich.:	A3B4C20D26 (1)
Weight, g/mol:	469.116152
ΔH_f, kcal/mol:	-90.87
Dipole, Da:	2.91
IP(EA), eV:	-9.0(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,10R)-5-hydroxy-3-(4-hydroxyphenyl)-10-[(3R)-2-oxo-3H-quinolin-3-yl]-2,3,9,10-tetrahydropyrano[2,3-h]chromene-4,8-dione

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)C[C@@H]1C(=O)N(C(=O)N1)CCC2=C3C=CC=CC3=NC2

DOS

IR

Vibrations