Geometry & MOs

Info

ID:	359295
PubChem CID:	127298227
Reduced:	SO4N5C17H29 (1)
Stoich.:	AB4C5D17E29 (1)
Weight, g/mol:	306.205576
ΔH_f, kcal/mol:	-139.86
Dipole, Da:	4.06
IP(EA), eV:	-8.75(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-morpholin-4-ylethyl)pyrazol-3-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=NN(C=C2)CCN3CCOCC3

DOS

IR

Vibrations