Geometry & MOs

Info

ID:	144471
PubChem CID:	53374459
Reduced:	FO2N4H31C32 (1)
Stoich.:	AB2C4D31E32 (1)
Weight, g/mol:	448.082599
ΔH_f, kcal/mol:	-31.66
Dipole, Da:	3.72
IP(EA), eV:	-9.08(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-chloroacetyl)amino]-9,10-dioxoanthracen-1-yl]-2-phenoxyacetamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(C2=CC(=CC=C2)F)O)C3=NC=NC4=C3CN(CC4)C(=O)C5=CC=C(C=C5)C6=CC=CC=C6

DOS

IR

Vibrations