Geometry & MOs

Info

ID:	186696
PubChem CID:	77468399
Reduced:	SF2N2O4C26H26 (1)
Stoich.:	AB2C2D4E26F26 (1)
Weight, g/mol:	471.189317
ΔH_f, kcal/mol:	-190.85
Dipole, Da:	4.3
IP(EA), eV:	-9.09(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,10,11,12a-tetrahydroxy-7-(1-hydroxyhexyl)-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide

Drug info:

PubChemData

Smile

CC1(C(S(=O)(=O)N=C(O1)NC(CCO)C2=C(C=C(C=C2)F)F)C3=CC=C(C=C3)C4=CC=CC=C4)C

DOS

IR

Vibrations