Geometry & MOs

Info

ID:	272559
PubChem CID:	103746883
Reduced:	NF3O3C12H14 (1)
Stoich.:	AB3C3D12E14 (1)
Weight, g/mol:	286.148141
ΔH_f, kcal/mol:	-275.59
Dipole, Da:	5.09
IP(EA), eV:	-8.9(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-[(4-fluoro-3,5-dimethylphenyl)methyl]urea

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCO)NC(=O)COCC(F)(F)F

DOS

IR

Vibrations