Geometry & MOs

Info

ID:	72701
PubChem CID:	48416454
Reduced:	O2N6C15H18 (1)
Stoich.:	A2B6C15D18 (1)
Weight, g/mol:	382.211724
ΔH_f, kcal/mol:	-2.55
Dipole, Da:	1.94
IP(EA), eV:	-9.33(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-(2,4-dimethylphenyl)-5-methyltriazole-4-carbonyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=CC3=NNN=C3C=C2)N4CCNC4=O

DOS

IR

Vibrations