Geometry & MOs

Info

ID:	396911
PubChem CID:	135029418
Reduced:	FN3O7C29H46 (1)
Stoich.:	AB3C7D29E46 (1)
Weight, g/mol:	318.089209
ΔH_f, kcal/mol:	-430.11
Dipole, Da:	2.69
IP(EA), eV:	-9.64(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[hydroxy(phenyl)methyl]-4H-xanthene-3,9-dione

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@H](CC(C)(C)F)NC(=O)[C@H](CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

DOS

IR

Vibrations