Geometry & MOs

Info

ID:	307012
PubChem CID:	125264653
Reduced:	SN2O4C15H24 (1)
Stoich.:	AB2C4D15E24 (1)
Weight, g/mol:	328.145678
ΔH_f, kcal/mol:	-141.28
Dipole, Da:	6.45
IP(EA), eV:	-9.03(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,3aS,7aR)-1-ethylsulfonyl-N-(furan-2-ylmethyl)-N-methyl-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-3-amine

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1C[C@@H]([C@@H]2[C@H]1CCCO2)N(C)CC3=CC=CO3

DOS

IR

Vibrations