Geometry & MOs

Info

ID:	197638
PubChem CID:	78983855
Reduced:	ON3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	203.105862
ΔH_f, kcal/mol:	-10.39
Dipole, Da:	9.08
IP(EA), eV:	-8.94(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-cyano-2-methylphenyl)-1,1-dimethylurea

Drug info:

PubChemData

Smile

CCN(CC)C(=O)NC1=C(C=CC(=C1)C#N)C

DOS

IR

Vibrations