Geometry & MOs

Info

ID:	351279
PubChem CID:	127280167
Reduced:	O3N5C19H29 (1)
Stoich.:	A3B5C19D29 (1)
Weight, g/mol:	361.247775
ΔH_f, kcal/mol:	-109.68
Dipole, Da:	5.13
IP(EA), eV:	-9.07(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[4-(5-ethyl-1H-pyrazole-3-carbonyl)piperazin-1-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CN2CCN(CC2)C(=O)CN3C=CC=NC3=O

DOS

IR

Vibrations