Geometry & MOs

Info

ID:	49067
PubChem CID:	11528673
Reduced:	NO3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	223.110947
ΔH_f, kcal/mol:	-138.89
Dipole, Da:	1.91
IP(EA), eV:	-10.1(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-methylphenyl)-1H-indazol-3-amine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C1=O)CC=C2

DOS

IR

Vibrations