Geometry & MOs

Info

ID:	48958
PubChem CID:	11528522
Reduced:	F3H9C11 (1)
Stoich.:	A3B9C11 (1)
Weight, g/mol:	198.090546
ΔH_f, kcal/mol:	-111.33
Dipole, Da:	3.43
IP(EA), eV:	-9.82(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-pyrrol-1-yl-1H-indazol-3-amine

Drug info:

PubChemData

Smile

C=C/C=C(\C1=CC=CC=C1)/C(F)(F)F

DOS

IR

Vibrations