Geometry & MOs

Info

ID:	310521
PubChem CID:	126581512
Reduced:	FO2N3C18H20 (1)
Stoich.:	AB2C3D18E20 (1)
Weight, g/mol:	345.160103
ΔH_f, kcal/mol:	-80.93
Dipole, Da:	3.04
IP(EA), eV:	-9.02(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-3-(3-methyl-1-nitrosohexan-3-yl)-1H-pyrazolo[1,5-a]benzimidazole-8-carboxamide

Drug info:

PubChemData

Smile

C1CC2=C(C=C(C=C2NC3=C(C=NC31)C4CCOCC4)F)C(=O)N

DOS

IR

Vibrations