Geometry & MOs

Info

ID:	79783
PubChem CID:	49830349
Reduced:	OSN5H15C19 (1)
Stoich.:	ABC5D15E19 (1)
Weight, g/mol:	393.140117
ΔH_f, kcal/mol:	63.42
Dipole, Da:	7.34
IP(EA), eV:	-8.74(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(3-amino-5-fluoro-1H-indazol-4-yl)phenyl]-3-(2-fluoro-5-methylphenyl)urea

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C3=CSC4=NC=NC(=C34)N

DOS

IR

Vibrations