Geometry & MOs

Info

ID:	123537
PubChem CID:	50852999
Reduced:	O2S2N3C21H21 (1)
Stoich.:	A2B2C3D21E21 (1)
Weight, g/mol:	183.060804
ΔH_f, kcal/mol:	-40.77
Dipole, Da:	4.8
IP(EA), eV:	-8.63(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-difluoro-1-methylindazol-3-amine

Drug info:

PubChemData

Smile

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NC4=C(C5=C(S4)CCCC5)C(=O)N3

DOS

IR

Vibrations