Geometry & MOs

Info

ID:	72932
PubChem CID:	48416698
Reduced:	SO3N4C20H24 (1)
Stoich.:	AB3C4D20E24 (1)
Weight, g/mol:	373.130553
ΔH_f, kcal/mol:	-72.66
Dipole, Da:	5.13
IP(EA), eV:	-8.94(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[3-(2-chlorophenyl)-1H-pyrazole-5-carbonyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=NC(=CS2)C(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations