Geometry & MOs

Info

ID:	355605
PubChem CID:	127289363
Reduced:	O2N5C17H23 (1)
Stoich.:	A2B5C17D23 (1)
Weight, g/mol:	342.160437
ΔH_f, kcal/mol:	2.43
Dipole, Da:	7.01
IP(EA), eV:	-8.94(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-fluoro-1H-benzimidazol-4-yl)-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)C(=O)C3=NOC4=C3CCCC4

DOS

IR

Vibrations