Geometry & MOs

Info

ID:	279786
PubChem CID:	103845187
Reduced:	OCl2N2H12C14 (1)
Stoich.:	AB2C2D12E14 (1)
Weight, g/mol:	309.043567
ΔH_f, kcal/mol:	-12.43
Dipole, Da:	5.57
IP(EA), eV:	-8.78(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(2,5-dichlorophenyl)methylamino]phenyl]urea

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)NCC2=C(C=CC(=C2)Cl)Cl)C(=O)N

DOS

IR

Vibrations