Geometry & MOs

Info

ID:	72554
PubChem CID:	48416299
Reduced:	O3N5C22H29 (1)
Stoich.:	A3B5C22D29 (1)
Weight, g/mol:	389.167474
ΔH_f, kcal/mol:	-64.98
Dipole, Da:	8.6
IP(EA), eV:	-9.26(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[4,4,4-trifluoro-3-hydroxy-3-(1-methylimidazol-2-yl)butanoyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations