Geometry & MOs

Info

ID:	31001
PubChem CID:	854075
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	311.152144
ΔH_f, kcal/mol:	-101.91
Dipole, Da:	3.93
IP(EA), eV:	-8.01(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 5-phenylfuran-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C[C@H]1C2=C(CCN1)C3=C(N2)C=CC(=C3)OC

DOS

IR

Vibrations