Geometry & MOs

Info

ID:	130285
PubChem CID:	51075510
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	311.092436
ΔH_f, kcal/mol:	-147.61
Dipole, Da:	3.15
IP(EA), eV:	-9.52(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(5-chlorofuran-2-carbonyl)-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1CC2CCCCC2N1C(=O)C3=COC=C3

DOS

IR

Vibrations