Geometry & MOs

Info

ID:	293051
PubChem CID:	117372430
Reduced:	ClON3H10C12 (1)
Stoich.:	ABC3D10E12 (1)
Weight, g/mol:	247.087625
ΔH_f, kcal/mol:	54.16
Dipole, Da:	2.16
IP(EA), eV:	-8.42(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(6-chloro-2,3-dihydro-1H-inden-4-yl)-2-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

CN1C=C(C2=C1C=CC(=C2)C3=NOC(=C3)N)Cl

DOS

IR

Vibrations