Geometry & MOs

Info

ID:	180010
PubChem CID:	76566720
Reduced:	O8C11H16 (1)
Stoich.:	A8B11C16 (1)
Weight, g/mol:	449.129314
ΔH_f, kcal/mol:	-350.85
Dipole, Da:	1.4
IP(EA), eV:	-10.42(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-diphenylphosphoryloxy-3-indol-2-ylidene-2,5-dihydroindazole

Drug info:

PubChemData

Smile

CC(CO)(CO)COC(=O)C=C(CC(=O)O)C(=O)O

DOS

IR

Vibrations