Geometry & MOs

Info

ID:	427364
PubChem CID:	135157687
Reduced:	NOC10H19 (1)
Stoich.:	ABC10D19 (1)
Weight, g/mol:	237.147727
ΔH_f, kcal/mol:	-81.91
Dipole, Da:	4.96
IP(EA), eV:	-9.69(1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-(3-methylpyrazol-1-yl)-1-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CCCC(C)(C)[C@@H]1CC(=O)NC1

DOS

IR

Vibrations