Geometry & MOs

Info

ID:	333688
PubChem CID:	127252240
Reduced:	O3N5C25H31 (1)
Stoich.:	A3B5C25D31 (1)
Weight, g/mol:	386.199428
ΔH_f, kcal/mol:	-38.61
Dipole, Da:	5.68
IP(EA), eV:	-8.56(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(6-benzylpyridin-2-yl)morpholin-4-yl]-3-phenylpropan-1-one

Drug info:

PubChemData

Smile

CC1=NN2C(=CC=NC2=C1CN3CCOCC3)C4CN(CCO4)C(=O)CCC5=CC=CC=C5

DOS

IR

Vibrations