Geometry & MOs

Info

ID:	257266
PubChem CID:	103144794
Reduced:	ON4C16H16 (1)
Stoich.:	AB4C16D16 (1)
Weight, g/mol:	219.137162
ΔH_f, kcal/mol:	19.45
Dipole, Da:	7.95
IP(EA), eV:	-8.2(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-amino-2,5-dimethylphenyl)-3-cyclopropylurea

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NC(=O)NC2=CC=C(C=C2)C#N)C)N

DOS

IR

Vibrations