Geometry & MOs

Info

ID:	370573
PubChem CID:	127339708
Reduced:	ON5C17H19 (1)
Stoich.:	AB5C17D19 (1)
Weight, g/mol:	368.221226
ΔH_f, kcal/mol:	51.35
Dipole, Da:	4.52
IP(EA), eV:	-9.09(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1-methylpyrazol-4-yl)piperidin-1-yl]-[3-(morpholin-4-ylmethyl)phenyl]methanone

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2CCN(CC2)C(=O)C3=CC=CC4=C3NN=C4

DOS

IR

Vibrations