Geometry & MOs

Info

ID:	72941
PubChem CID:	48416708
Reduced:	N3O3C19H27 (1)
Stoich.:	A3B3C19D27 (1)
Weight, g/mol:	402.152575
ΔH_f, kcal/mol:	-118.46
Dipole, Da:	6.69
IP(EA), eV:	-8.88(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-[(4-fluorophenyl)methyl]-4-methyl-1,3-thiazole-5-carbonyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC(C)C1=CC(=CC=C1)OCC(=O)N2CCCC(C2)N3CCNC3=O

DOS

IR

Vibrations