Geometry & MOs

Info

ID:	393441
PubChem CID:	135020601
Reduced:	O6H26C29 (1)
Stoich.:	A6B26C29 (1)
Weight, g/mol:	324.11503
ΔH_f, kcal/mol:	-137.24
Dipole, Da:	4.9
IP(EA), eV:	-8.53(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-phenyl-5,6-dihydrobenzo[c]xanthen-7-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)/C=C/C2=CC3=C(C(=C2)C)OC(=O)C(=C3)C4=CC(=C(C(=C4)OC)OC)OC

DOS

IR

Vibrations