Geometry & MOs

Info

ID:	307013
PubChem CID:	125264655
Reduced:	SN2O4C15H24 (1)
Stoich.:	AB2C4D15E24 (1)
Weight, g/mol:	295.099063
ΔH_f, kcal/mol:	-134.06
Dipole, Da:	4.05
IP(EA), eV:	-8.85(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3aR,6aS)-4-acetyl-N-(4-methyl-1,3-thiazol-2-yl)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations