Geometry & MOs

Info

ID:	57407
PubChem CID:	22395844
Reduced:	SCl2N3O5C19H19 (1)
Stoich.:	AB2C3D5E19F19 (1)
Weight, g/mol:	538.01907
ΔH_f, kcal/mol:	-170.46
Dipole, Da:	6.56
IP(EA), eV:	-10.22(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(3,5-dichlorophenyl)sulfonyl-1,3-thiazolidine-2-carbonyl]amino]-3-naphthalen-2-ylpropanoic acid

Drug info:

PubChemData

Smile

C1CC(N(C1)S(=O)(=O)C2=CC(=CC(=C2)Cl)Cl)C(=O)NC(CC3=CC=NC=C3)C(=O)O

DOS

IR

Vibrations