Geometry & MOs

Info

ID:	169183
PubChem CID:	75072221
Reduced:	O14C37H56 (1)
Stoich.:	A14B37C56 (1)
Weight, g/mol:	391.178358
ΔH_f, kcal/mol:	-672.54
Dipole, Da:	1.3
IP(EA), eV:	-10.05(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-3-methoxy-4-(3-methylbut-2-enyl)-2-(3-methylbut-1-enylidene)-10H-acridine-1,9-dione

Drug info:

PubChemData

Smile

CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)O)OC7C(C(C(C(O7)CO)O)O)O

DOS

IR

Vibrations