Geometry & MOs

Info

ID:	295139
PubChem CID:	117518316
Reduced:	BrO3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	352.07864
ΔH_f, kcal/mol:	-100.4
Dipole, Da:	5.36
IP(EA), eV:	-9.74(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(4-bromo-7-methoxy-2-methyl-1-benzofuran-5-yl)-1-methylpyrrolidin-3-yl]methanamine

Drug info:

PubChemData

Smile

C1CCC(CC1)(C2=C(C(=CC=C2)Br)OCC3CC3)C(=O)O

DOS

IR

Vibrations