Geometry & MOs

Info

ID:	67633
PubChem CID:	46506856
Reduced:	N3O5H19C22 (1)
Stoich.:	A3B5C19D22 (1)
Weight, g/mol:	358.135114
ΔH_f, kcal/mol:	-25.72
Dipole, Da:	7.26
IP(EA), eV:	-8.91(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(3-phenylpropyl)benzamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC2=C1O/C(=N\OC(=O)C)/C(=C2)C3=NC(=NO3)C4=CC=C(C=C4)C

DOS

IR

Vibrations