Geometry & MOs

Info

ID:	269465
PubChem CID:	103617588
Reduced:	BrNOCl2S2H8C11 (1)
Stoich.:	ABCD2E2F8G11 (1)
Weight, g/mol:	284.09277
ΔH_f, kcal/mol:	18.75
Dipole, Da:	3.85
IP(EA), eV:	-9.45(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(5-chlorofuran-2-carbonyl)piperidin-4-yl]methyl]acetamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=CS1)Br)C(=O)C2=C(SC(=C2)Cl)Cl

DOS

IR

Vibrations