Geometry & MOs

Info

ID:	331989
PubChem CID:	127250275
Reduced:	NOC12H13 (2)
Stoich.:	ABC12D13 (2)
Weight, g/mol:	346.179361
ΔH_f, kcal/mol:	-4.01
Dipole, Da:	2.0
IP(EA), eV:	-8.86(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-phenylethyl)-2-(5-pyrimidin-5-ylpyridin-2-yl)morpholine

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C2=CN=C(C=C2)C3CN(CCO3)CCC4=CC=CC=C4

DOS

IR

Vibrations