Geometry & MOs

Info

ID:	291234
PubChem CID:	111978226
Reduced:	BrFO2N4C18H26 (1)
Stoich.:	ABC2D4E18F26 (1)
Weight, g/mol:	506.05421
ΔH_f, kcal/mol:	-118.97
Dipole, Da:	2.71
IP(EA), eV:	-9.14(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(4-bromophenyl)methyl]-N-ethyl-3-pyrrolidin-1-ylpyrrolidine-1-carboximidamide;hydroiodide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCN(C1)C(=NC)NCC2=C(C=C(C=C2)Br)F

DOS

IR

Vibrations