Geometry & MOs

Info

ID:	44586
PubChem CID:	10504213
Reduced:	SN3O6C22H27 (1)
Stoich.:	AB3C6D22E27 (1)
Weight, g/mol:	461.213698
ΔH_f, kcal/mol:	-187.69
Dipole, Da:	7.47
IP(EA), eV:	-9.28(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-N-[[4-(5-phenylpentoxy)phenyl]methyl]-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)C(=O)N2CCN(C(C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)OC

DOS

IR

Vibrations