Geometry & MOs

Info

ID:	137759
PubChem CID:	52258318
Reduced:	ON3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	288.127406
ΔH_f, kcal/mol:	14.62
Dipole, Da:	8.38
IP(EA), eV:	-9.17(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-fluoro-2-methylphenyl)-1-[(2-hydroxyphenyl)methyl]-1-methylurea

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)CNC(=O)NC2=CC=C(C=C2)C#N)C

DOS

IR

Vibrations