Geometry & MOs

Info

ID:	147119
PubChem CID:	53786772
Reduced:	O7C23H32 (1)
Stoich.:	A7B23C32 (1)
Weight, g/mol:	284.173607
ΔH_f, kcal/mol:	-202.36
Dipole, Da:	7.19
IP(EA), eV:	-9.58(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-5-(5-aminopentyl)nonane-3,4,6,7-tetrone

Drug info:

PubChemData

Smile

CC(C)C12C(O1)C3C4(O3)[C@]5(CCC(=C(C5CC6C4(C2OC)O6)COC)C(=O)OC)C

DOS

IR

Vibrations