Geometry & MOs

Info

ID:	306863
PubChem CID:	125263966
Reduced:	NO2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	294.157957
ΔH_f, kcal/mol:	-185.62
Dipole, Da:	4.27
IP(EA), eV:	-9.36(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3aR,5S,7aS)-5-(ethoxymethyl)-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone

Drug info:

PubChemData

Smile

CC(=O)N1CC[C@H]2[C@H]1CC[C@H](O2)COCC(=O)N3CCCC3

DOS

IR

Vibrations