Geometry & MOs

Info

ID:	331929
PubChem CID:	127250215
Reduced:	FO2N3H26C27 (1)
Stoich.:	AB2C3D26E27 (1)
Weight, g/mol:	348.195011
ΔH_f, kcal/mol:	-43.42
Dipole, Da:	4.52
IP(EA), eV:	-8.62(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC2=CN=C(C=C2)C3CN(CCO3)C(=O)C4=CC5=C(N4C)C=CC(=C5)F

DOS

IR

Vibrations