Geometry & MOs

Info

ID:	164307
PubChem CID:	74382802
Reduced:	N2S2O6C27H38 (1)
Stoich.:	A2B2C6D27E38 (1)
Weight, g/mol:	448.275964
ΔH_f, kcal/mol:	-199.92
Dipole, Da:	2.71
IP(EA), eV:	-9.27(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-yl)-N-tetradecyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)N(C)C(CC1=CC=CC=C1)C(CN(CC(C)C)S(=O)(=O)C2=CC3=C(C=C2)OC=C3)OC

DOS

IR

Vibrations