Geometry & MOs

Info

ID:	313678
PubChem CID:	126617166
Reduced:	OSCl2N4H32C34 (1)
Stoich.:	ABC2D4E32F34 (1)
Weight, g/mol:	466.132717
ΔH_f, kcal/mol:	87.67
Dipole, Da:	5.37
IP(EA), eV:	-8.69(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(4-chlorophenyl)-[3-(piperidin-4-ylamino)-1H-indazol-5-yl]methanol

Drug info:

PubChemData

Smile

C1CC1N2C(=C3C=C(C=CC3=N2)C(C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl)C6CCN(CC6)CC7=CC(=CS7)C(=O)N

DOS

IR

Vibrations