Geometry & MOs

Info

ID:	183986
PubChem CID:	77099167
Reduced:	BrN3C13H20 (1)
Stoich.:	AB3C13D20 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	27.73
Dipole, Da:	5.13
IP(EA), eV:	-9.05(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-4-[2-(2-propan-2-ylpyrrolidin-1-yl)ethoxy]benzenecarboximidamide

Drug info:

PubChemData

Smile

CCC(CC1CC(NN1)C2=CC=C(C=C2)Br)N

DOS

IR

Vibrations