Geometry & MOs

Info

ID:	427472
PubChem CID:	135159199
Reduced:	NS2H45C49 (1)
Stoich.:	AB2C45D49 (1)
Weight, g/mol:	519.288577
ΔH_f, kcal/mol:	238.34
Dipole, Da:	1.87
IP(EA), eV:	-7.71(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-piperidin-2-ylspiro[5,6-dihydroxanthene-9,9'-xanthene]-3-yl)-N'-propylmethanediamine

Drug info:

PubChemData

Smile

C1CC2=C(C=C1)C3CC(CCC3N2C4=CC=CC=C4)C5=CC6C(C=C5)C7(C8C=CC=CC8SC9=CC=CC=C97)C1C=CC(=CC1S6)C1=CC=CC=C1

DOS

IR

Vibrations