Geometry & MOs

Info

ID:	307028
PubChem CID:	125264694
Reduced:	N2O4C17H26 (1)
Stoich.:	A2B4C17D26 (1)
Weight, g/mol:	344.086449
ΔH_f, kcal/mol:	-141.58
Dipole, Da:	4.61
IP(EA), eV:	-8.86(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,3aR,7aS)-1-(2-thiophen-3-ylacetyl)-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-3-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CN(C)CCOC[C@@H]1CC[C@H]2[C@@H](O1)CCN2C(=O)C3=COC=C3

DOS

IR

Vibrations