Geometry & MOs

Info

ID:	260759
PubChem CID:	103202947
Reduced:	N5H15C16 (1)
Stoich.:	A5B15C16 (1)
Weight, g/mol:	269.164046
ΔH_f, kcal/mol:	121.34
Dipole, Da:	7.14
IP(EA), eV:	-8.3(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(2-imidazol-1-ylcyclopentyl)amino]methyl]-1-methylpyrrole-2-carbonitrile

Drug info:

PubChemData

Smile

CN1C=C(C=C1C#N)CNC2=CC=C(C=C2)C3=CC=NN3

DOS

IR

Vibrations