Geometry & MOs

Info

ID:	18970
PubChem CID:	551932
Reduced:	ClN2O2C11H15 (1)
Stoich.:	AB2C2D11E15 (1)
Weight, g/mol:	242.082205
ΔH_f, kcal/mol:	-60.29
Dipole, Da:	4.25
IP(EA), eV:	-8.56(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-methoxyphenyl)-1,3,3-trimethylurea

Drug info:

PubChemData

Smile

CN(C)C(=O)N(C)C1=CC(=C(C=C1)OC)Cl

DOS

IR

Vibrations