Geometry & MOs

Info

ID:	347214
PubChem CID:	127271755
Reduced:	ON4C19H30 (1)
Stoich.:	AB4C19D30 (1)
Weight, g/mol:	347.257277
ΔH_f, kcal/mol:	-36.05
Dipole, Da:	5.39
IP(EA), eV:	-8.71(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-1-methyl-N-[2-(2-methylcyclohexyl)oxyethyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)C2CCCCC2)C(=O)NC3CCN4C3CCCC4

DOS

IR

Vibrations