Geometry & MOs

Info

ID:	226666
PubChem CID:	87550995
Reduced:	ClOSN4C15H17 (1)
Stoich.:	ABCD4E15F17 (1)
Weight, g/mol:	344.99932
ΔH_f, kcal/mol:	29.82
Dipole, Da:	2.81
IP(EA), eV:	-9.11(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dichloro-4-[4-(dimethylamino)phenyl]benzenesulfonic acid

Drug info:

PubChemData

Smile

C1CC1N(CCN)C(=O)C2=C(SC(=N2)N)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations