Geometry & MOs

Info

ID:	347131
PubChem CID:	127271635
Reduced:	NOC7H9 (3)
Stoich.:	ABC7D9 (3)
Weight, g/mol:	388.283826
ΔH_f, kcal/mol:	-81.71
Dipole, Da:	6.08
IP(EA), eV:	-8.55(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-1-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)C2CCCCC2)C(=O)NCCC3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations