Geometry & MOs

Info

ID:	390931
PubChem CID:	135001651
Reduced:	FO2H15C16 (1)
Stoich.:	AB2C15D16 (1)
Weight, g/mol:	237.126598
ΔH_f, kcal/mol:	-70.51
Dipole, Da:	5.67
IP(EA), eV:	-8.25(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(2-methylphenyl)-1H-indazol-5-amine

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)/C=C/C2=CC=C(C=C2)F)OC

DOS

IR

Vibrations