Geometry & MOs

Info

ID:	329861
PubChem CID:	127246728
Reduced:	O3N5C15H19 (1)
Stoich.:	A3B5C15D19 (1)
Weight, g/mol:	349.19026
ΔH_f, kcal/mol:	-88.86
Dipole, Da:	5.93
IP(EA), eV:	-8.55(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]-2-(2-methylbenzimidazol-1-yl)ethanone

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2C(=O)CN3C(=O)CNC3=O

DOS

IR

Vibrations