Geometry & MOs

Info

ID:	72599
PubChem CID:	48416347
Reduced:	O4N5C19H23 (1)
Stoich.:	A4B5C19D23 (1)
Weight, g/mol:	319.200825
ΔH_f, kcal/mol:	-78.17
Dipole, Da:	4.85
IP(EA), eV:	-9.15(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1=NC(=NO1)COC2=CC=C(C=C2)C(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations