Geometry & MOs

Info

ID:	311641
PubChem CID:	126596618
Reduced:	NC19H41 (1)
Stoich.:	AB19C41 (1)
Weight, g/mol:	556.25848
ΔH_f, kcal/mol:	-90.25
Dipole, Da:	1.53
IP(EA), eV:	-8.72(3.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aS,12aR)-8-[[(1-ethylcyclobutyl)methyl-propylamino]methyl]-7-fluoro-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCCC(C)(CCCC)CNCCC(C)(C)C

DOS

IR

Vibrations