Geometry & MOs

Info

ID:	160884
PubChem CID:	57390124
Reduced:	OSN4H18C23 (1)
Stoich.:	ABC4D18E23 (1)
Weight, g/mol:	270.043902
ΔH_f, kcal/mol:	86.58
Dipole, Da:	4.19
IP(EA), eV:	-8.76(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)indazole;hydrochloride

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NC2=C3C=C(SC3=NC=N2)C(=O)C4=CC5=CC=CC=C5N4

DOS

IR

Vibrations