Geometry & MOs

Info

ID:	351301
PubChem CID:	127280189
Reduced:	O2N5C20H33 (1)
Stoich.:	A2B5C20D33 (1)
Weight, g/mol:	347.232125
ΔH_f, kcal/mol:	-77.57
Dipole, Da:	3.72
IP(EA), eV:	-8.98(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-methyl-2-[4-(2-pyrazol-1-ylacetyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC(=O)N2CCN(CC2)CC(=O)N(C)C3CCCCC3)C

DOS

IR

Vibrations