Geometry & MOs

Info

ID:	290602
PubChem CID:	109764705
Reduced:	N7C17H27 (1)
Stoich.:	A7B17C27 (1)
Weight, g/mol:	541.15499
ΔH_f, kcal/mol:	81.62
Dipole, Da:	4.09
IP(EA), eV:	-9.35(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[[[ethylamino-(3-imidazol-1-yl-4-methylpiperidin-1-yl)methylidene]amino]methyl]-2-methoxybenzoate;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCCN1C=CC=N1)N2CCC(C(C2)N3C=CN=C3)C

DOS

IR

Vibrations