Geometry & MOs

Info

ID:	331881
PubChem CID:	127250167
Reduced:	N2O2C12H13 (2)
Stoich.:	A2B2C12D13 (2)
Weight, g/mol:	378.18559
ΔH_f, kcal/mol:	-65.09
Dipole, Da:	4.69
IP(EA), eV:	-8.28(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,6-dimethylpyrimidin-4-yl)-2-[5-[(2-fluorophenyl)methyl]pyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)C(=O)N2CCOC(C2)C3=NC=C(C=C3)CC4=C(C=CC(=C4)OC)OC

DOS

IR

Vibrations