Geometry & MOs

Info

ID:	351249
PubChem CID:	127279807
Reduced:	ON2C9H10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	375.263425
ΔH_f, kcal/mol:	-16.45
Dipole, Da:	7.16
IP(EA), eV:	-8.37(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-methyl-2-[4-[3-(1-methylpyrazol-4-yl)propanoyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN1C(=C(C=N1)C(=O)NC2=CC3=C(C=C2)NC(=O)CCC3)C4CC4

DOS

IR

Vibrations