Geometry & MOs

Info

ID:	401141
PubChem CID:	135050289
Reduced:	NOSC13H17 (1)
Stoich.:	ABCD13E17 (1)
Weight, g/mol:	390.130612
ΔH_f, kcal/mol:	-16.3
Dipole, Da:	4.69
IP(EA), eV:	-8.66(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R,3S,4R,6R)-5,5,6-triacetamido-4-acetyl-2-chlorooxan-3-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)N/C(=C/C(=O)C1=CC=CC=C1)/SC

DOS

IR

Vibrations