Geometry & MOs

Info

ID:	446052
PubChem CID:	135272050
Reduced:	NO3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	601.48588
ΔH_f, kcal/mol:	-110.3
Dipole, Da:	2.68
IP(EA), eV:	-10.11(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(9-amino-3,7,8,8-tetramethylnonan-3-yl)-6-(3,7,8,8-tetramethyldecan-3-yl)anthracene-9,10-dione

Drug info:

PubChemData

Smile

CC(CC=O)CC(C)CN1C(=O)C=CC1=O

DOS

IR

Vibrations