Geometry & MOs

Info

ID:	311017
PubChem CID:	126588819
Reduced:	NO2F3C22H26 (1)
Stoich.:	AB2C3D22E26 (1)
Weight, g/mol:	356.209993
ΔH_f, kcal/mol:	-229.12
Dipole, Da:	2.91
IP(EA), eV:	-8.6(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-ethoxy-2-[(4-ethyl-2-methylphenoxy)methyl]phenyl]-1,3-dimethylurea

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2N(CC)C(=O)CC)C(F)(F)F)C

DOS

IR

Vibrations