Geometry & MOs

Info

ID:	37040
PubChem CID:	8016336
Reduced:	SO5H18C23 (1)
Stoich.:	AB5C18D23 (1)
Weight, g/mol:	379.118163
ΔH_f, kcal/mol:	-57.49
Dipole, Da:	5.95
IP(EA), eV:	-8.4(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2-[(8,8-dimethyl-2-oxo-4-phenyl-9,10-dihydropyrano[2,3-h]chromen-5-yl)oxy]acetate

Drug info:

PubChemData

Smile

CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC=C(C=C3)SC)OC(=O)C4=CC=CO4

DOS

IR

Vibrations