Geometry & MOs

Info

ID:	149785
PubChem CID:	53789461
Reduced:	NO3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	467.993337
ΔH_f, kcal/mol:	-71.1
Dipole, Da:	3.21
IP(EA), eV:	-9.41(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-(carboxysulfamoyl)-9,10-dioxoanthracen-2-yl]sulfonyl-methylcarbamic acid

Drug info:

PubChemData

Smile

CCC(=NOCC)C1C(=O)CC(CC1=O)C2=CC=CC=C2

DOS

IR

Vibrations