Geometry & MOs

Info

ID:	145251
PubChem CID:	53487911
Reduced:	BrClC10H12 (1)
Stoich.:	ABC10D12 (1)
Weight, g/mol:	260.078348
ΔH_f, kcal/mol:	-4.76
Dipole, Da:	3.46
IP(EA), eV:	-9.42(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluoro-4-methylphenyl)-3-phenylthiourea

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C=C1)Br)Cl

DOS

IR

Vibrations