Geometry & MOs

Info

ID:	255164
PubChem CID:	103130468
Reduced:	ON4C11H18 (1)
Stoich.:	AB4C11D18 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	11.76
Dipole, Da:	5.5
IP(EA), eV:	-8.23(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethylmorpholin-2-yl)-(1-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CN1CCN(C(C1)C(=O)C2=NN(C=C2)C)C

DOS

IR

Vibrations