Geometry & MOs

Info

ID:	293360
PubChem CID:	117385617
Reduced:	FNO3C13H16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	253.132746
ΔH_f, kcal/mol:	-144.1
Dipole, Da:	2.54
IP(EA), eV:	-8.78(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)-2-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

C1CCC(C1)(CN)C2=C(C(=CC3=C2OCO3)O)F

DOS

IR

Vibrations