Geometry & MOs

Info

ID:	330370
PubChem CID:	127247357
Reduced:	ON5C19H23 (1)
Stoich.:	AB5C19D23 (1)
Weight, g/mol:	337.19026
ΔH_f, kcal/mol:	18.46
Dipole, Da:	6.32
IP(EA), eV:	-8.79(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylbenzimidazol-1-yl)-1-[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCCCN2C(=O)CCC3=NC4=CC=CC=C4N3

DOS

IR

Vibrations