Geometry & MOs

Info

ID:	426463
PubChem CID:	135144300
Reduced:	FCl2N4C10H13 (1)
Stoich.:	AB2C4D10E13 (1)
Weight, g/mol:	386.165523
ΔH_f, kcal/mol:	-32.47
Dipole, Da:	1.51
IP(EA), eV:	-8.55(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyclopropyl-3H-benzimidazol-5-yl)-4-[(6-fluoro-1H-indol-2-yl)methyl]pyrazol-3-amine

Drug info:

PubChemData

Smile

C1CC1(C2=NC3=C(N2)C=C(C=C3)NN)F.Cl.Cl

DOS

IR

Vibrations