Geometry & MOs

Info

ID:	349144
PubChem CID:	127274870
Reduced:	SN3O3C18H23 (1)
Stoich.:	AB3C3D18E23 (1)
Weight, g/mol:	272.119464
ΔH_f, kcal/mol:	-100.98
Dipole, Da:	3.56
IP(EA), eV:	-8.96(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-(oxane-4-carbonyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1CSCN1C(=O)C2=CC=C(C=C2)CN3CCCC3=O

DOS

IR

Vibrations