Geometry & MOs

Info

ID:	291235
PubChem CID:	111978229
Reduced:	BrIN4C18H28 (1)
Stoich.:	ABC4D18E28 (1)
Weight, g/mol:	382.11684
ΔH_f, kcal/mol:	31.56
Dipole, Da:	6.01
IP(EA), eV:	-8.91(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-bromo-2-fluorophenyl)methyl]-N'-methyl-3-pyrrolidin-1-ylpyrrolidine-1-carboximidamide

Drug info:

PubChemData

Smile

CCNC(=NCC1=CC=C(C=C1)Br)N2CCC(C2)N3CCCC3.I

DOS

IR

Vibrations