Geometry & MOs

Info

ID:	171417
PubChem CID:	75375586
Reduced:	O2N3C20H31 (1)
Stoich.:	A2B3C20D31 (1)
Weight, g/mol:	327.98811
ΔH_f, kcal/mol:	-94.58
Dipole, Da:	4.02
IP(EA), eV:	-9.32(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-bromophenyl)ethyl]-2-oxo-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CN(C1CCN(CC1)CC2=CC=NC=C2)C(=O)CC3(CCCCC3)O

DOS

IR

Vibrations