Geometry & MOs

Info

ID:	12096
PubChem CID:	130146
Reduced:	SN2O3C24H28 (1)
Stoich.:	AB2C3D24E28 (1)
Weight, g/mol:	424.182064
ΔH_f, kcal/mol:	-59.55
Dipole, Da:	4.81
IP(EA), eV:	-7.89(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2,2-bis[4-(dimethylamino)phenyl]ethyl]benzenesulfonic acid

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C(CC2=CC=CC=C2S(=O)(=O)O)C3=CC=C(C=C3)N(C)C

DOS

IR

Vibrations