Geometry & MOs

Info

ID:	306857
PubChem CID:	125263954
Reduced:	NO2C8H12 (2)
Stoich.:	AB2C8D12 (2)
Weight, g/mol:	308.173607
ΔH_f, kcal/mol:	-134.42
Dipole, Da:	2.26
IP(EA), eV:	-9.11(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S,3aR,7aR)-3-[furan-2-ylmethyl(methyl)amino]-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-1-yl]-2-methoxyethanone

Drug info:

PubChemData

Smile

CN(CC1=CC=CO1)[C@H]2CN([C@@H]3[C@@H]2OCCC3)C(=O)COC

DOS

IR

Vibrations