Geometry & MOs

Info

ID:	156411
PubChem CID:	56370502
Reduced:	SN3O5C20H23 (1)
Stoich.:	AB3C5D20E23 (1)
Weight, g/mol:	334.149284
ΔH_f, kcal/mol:	-140.28
Dipole, Da:	7.94
IP(EA), eV:	-9.03(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(difluoromethyl)phenyl]-3-[2-(2,6-dimethylphenoxy)ethyl]urea

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)NC(=O)N[C@H]3[C@H](CC4=CC=CC=C34)O

DOS

IR

Vibrations