Geometry & MOs

Info

ID:	446821
PubChem CID:	135277996
Reduced:	O3N4C21H27 (2)
Stoich.:	A3B4C21D27 (2)
Weight, g/mol:	270.091689
ΔH_f, kcal/mol:	-208.25
Dipole, Da:	13.09
IP(EA), eV:	-9.06(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-fluoro-1H-indazol-4-yl)-3-phenylurea

Drug info:

PubChemData

Smile

CCCN(CCC)C(=O)C1=CC2=C(C=C(C=C2)C(=O)NC3=CN=CC(=C3)CNC(=O)CCCCCNC(=O)C4CCC(CC4)CN5C(=O)C=CC5=O)N=C(C1)N

DOS

IR

Vibrations