Geometry & MOs

Info

ID:	267322
PubChem CID:	103581812
Reduced:	BrClSN2O2C14H14 (1)
Stoich.:	ABCD2E2F14G14 (1)
Weight, g/mol:	352.99305
ΔH_f, kcal/mol:	-36.61
Dipole, Da:	3.86
IP(EA), eV:	-8.6(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(4-bromo-3-chlorophenyl)methylamino]phenyl]urea

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC=C(C=C1)NCC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations