Geometry & MOs

Info

ID:	136360
PubChem CID:	52027987
Reduced:	BrON4C19H19 (1)
Stoich.:	ABC4D19E19 (1)
Weight, g/mol:	324.147393
ΔH_f, kcal/mol:	23.68
Dipole, Da:	5.41
IP(EA), eV:	-8.69(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

furan-2-yl-[(2S)-2-(5-methoxy-1-methylindol-3-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CN1C=C(C2=C1C=CC(=C2)Br)[C@H]3CCCN3C(=O)C4=C(N=CC=C4)N

DOS

IR

Vibrations