Geometry & MOs

Info

ID:	333675
PubChem CID:	127252227
Reduced:	O3N5C25H31 (1)
Stoich.:	A3B5C25D31 (1)
Weight, g/mol:	372.183778
ΔH_f, kcal/mol:	-50.19
Dipole, Da:	5.33
IP(EA), eV:	-8.71(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(6-benzylpyridin-2-yl)morpholin-4-yl]-2-phenylethanone

Drug info:

PubChemData

Smile

CC1=NN2C(=CC=NC2=C1CN3CCC(CC3)O)C4CN(CCO4)C(=O)CC5=CC=CC=C5

DOS

IR

Vibrations