Geometry & MOs

Info

ID:	128894
PubChem CID:	51062598
Reduced:	N2O3Cl4H12C13 (1)
Stoich.:	A2B3C4D12E13 (1)
Weight, g/mol:	320.02727
ΔH_f, kcal/mol:	-121.76
Dipole, Da:	5.2
IP(EA), eV:	-8.98(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromo-2,6-dimethylphenyl)-3-pyrazin-2-ylurea

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)O

DOS

IR

Vibrations