Geometry & MOs

Info

ID:	349786
PubChem CID:	127276178
Reduced:	N3O3C19H27 (1)
Stoich.:	A3B3C19D27 (1)
Weight, g/mol:	345.114713
ΔH_f, kcal/mol:	-129.88
Dipole, Da:	3.11
IP(EA), eV:	-8.68(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(CN(C1)CC2=CC=CC=C2NC(=O)C3CCCOC3)C(=O)N

DOS

IR

Vibrations