Geometry & MOs

Info

ID:	332089
PubChem CID:	127250375
Reduced:	O3N5C25H25 (1)
Stoich.:	A3B5C25D25 (1)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	-1.04
Dipole, Da:	4.1
IP(EA), eV:	-8.5(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1-ethylpyrazol-4-yl)methyl]-2-[5-(3-methoxyphenyl)pyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)CCCOC2=CC=CC3=C2N=CC=C3)C4=NC=C(C=C4)C5=CNN=C5

DOS

IR

Vibrations