Geometry & MOs

Info

ID:	332064
PubChem CID:	127250350
Reduced:	FON4C20H21 (1)
Stoich.:	ABC4D20E21 (1)
Weight, g/mol:	368.140389
ΔH_f, kcal/mol:	10.93
Dipole, Da:	4.66
IP(EA), eV:	-9.02(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(3-chlorophenyl)pyridin-2-yl]-4-[(2-methylpyrazol-3-yl)methyl]morpholine

Drug info:

PubChemData

Smile

CN1C(=CC=N1)CN2CCOC(C2)C3=NC=C(C=C3)C4=CC=CC=C4F

DOS

IR

Vibrations