Geometry & MOs

Info

ID:	226537
PubChem CID:	87457815
Reduced:	N2O5F6C21H28 (1)
Stoich.:	A2B5C6D21E28 (1)
Weight, g/mol:	430.169112
ΔH_f, kcal/mol:	-542.47
Dipole, Da:	2.54
IP(EA), eV:	-9.73(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-diethyl-1-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-3-(2-hydroxy-2-methylpropyl)urea

Drug info:

PubChemData

Smile

CCN(CCCCO)C(=O)N(CCCCC(=O)O)C1=CC=C(C=C1)C(C(F)(F)F)(C(F)(F)F)O

DOS

IR

Vibrations