Geometry & MOs

Info

ID:	242268
PubChem CID:	96099800
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	288.158626
ΔH_f, kcal/mol:	-20.22
Dipole, Da:	3.28
IP(EA), eV:	-9.56(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(methylaminomethyl)-1-[(3S)-pyrrolidin-3-yl]benzimidazole-5-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)[C@H]2CCCN2C(=O)CCCC3=CC=CC=N3

DOS

IR

Vibrations