Geometry & MOs

Info

ID:	162144
PubChem CID:	57393761
Reduced:	N3O3C23H27 (1)
Stoich.:	A3B3C23D27 (1)
Weight, g/mol:	335.972208
ΔH_f, kcal/mol:	-86.53
Dipole, Da:	4.49
IP(EA), eV:	-8.36(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,5-dioxoimidazolidin-4-yl)benzene-1,3-disulfonic acid

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)OCCCN2C3=C(CCCC3)C4=C2C=CC(=C4)C(=O)OC)C

DOS

IR

Vibrations