Geometry & MOs

Info

ID:	64987
PubChem CID:	29204300
Reduced:	Cl3N4O4H17C19 (1)
Stoich.:	A3B4C4D17E19 (1)
Weight, g/mol:	371.994759
ΔH_f, kcal/mol:	-117.14
Dipole, Da:	4.42
IP(EA), eV:	-9.16(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(2,4,6-trichloroanilino)carbamoyl]phenyl]urea

Drug info:

PubChemData

Smile

C[C@@]1(C(=O)N(C(=O)N1)CC(=O)NNC2=C(C=C(C=C2Cl)Cl)Cl)C3=CC=C(C=C3)OC

DOS

IR

Vibrations