Geometry & MOs

Info

ID:	393281
PubChem CID:	135019928
Reduced:	NO5C19H23 (1)
Stoich.:	AB5C19D23 (1)
Weight, g/mol:	310.068447
ΔH_f, kcal/mol:	-151.7
Dipole, Da:	3.75
IP(EA), eV:	-7.97(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-chloro-2-(3,5-difluorophenyl)phenyl]-1,1-dimethylurea

Drug info:

PubChemData

Smile

CN[C@H]1CCC2=CC(=C(C(=C2C3=CC(=C(C=C13)OC)O)OC)O)OC

DOS

IR

Vibrations