Geometry & MOs

Info

ID:	234303
PubChem CID:	92298137
Reduced:	OF3N3C14H14 (1)
Stoich.:	AB3C3D14E14 (1)
Weight, g/mol:	342.157957
ΔH_f, kcal/mol:	-150.81
Dipole, Da:	4.15
IP(EA), eV:	-8.93(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[(2R)-2-hydroxy-3-pyrrolidin-1-ylpropyl]-[1]benzofuro[3,2-b]pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

C1C[C@@H](N([C@H]1C2=CC=CN2)C(=O)C(F)(F)F)C3=CC=CN3

DOS

IR

Vibrations