Geometry & MOs

Info

ID:	25969
PubChem CID:	635006
Reduced:	O9C23H26 (1)
Stoich.:	A9B23C26 (1)
Weight, g/mol:	446.387229
ΔH_f, kcal/mol:	-325.31
Dipole, Da:	2.42
IP(EA), eV:	-8.28(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-bis(aminomethyl)-3-(2,6,10,14-tetramethylhexadecyl)cyclohexa-2,5-diene-1,4-dione

Drug info:

PubChemData

Smile

CC(=O)OC1C(CC2=C(C(=C(C=C2O1)OC)OC)OC(=O)C)C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations