Geometry & MOs

Info

ID:	72649
PubChem CID:	48416398
Reduced:	O2S2N4C17H20 (1)
Stoich.:	A2B2C4D17E20 (1)
Weight, g/mol:	404.107375
ΔH_f, kcal/mol:	-30.9
Dipole, Da:	7.08
IP(EA), eV:	-9.12(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C2=CC=CS2)C(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations