Geometry & MOs

Info

ID:	341834
PubChem CID:	127264527
Reduced:	ClN2C13H21 (1)
Stoich.:	AB2C13D21 (1)
Weight, g/mol:	342.995107
ΔH_f, kcal/mol:	-18.14
Dipole, Da:	2.47
IP(EA), eV:	-8.68(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 4-amino-6-chlorobenzene-1,3-disulfonate

Drug info:

PubChemData

Smile

C1CN(CCC1C2=CC=CC=C2)CCN.Cl

DOS

IR

Vibrations