Geometry & MOs

Info

ID:	332011
PubChem CID:	127250297
Reduced:	O2N5H19C20 (1)
Stoich.:	A2B5C19D20 (1)
Weight, g/mol:	389.185175
ΔH_f, kcal/mol:	19.96
Dipole, Da:	2.21
IP(EA), eV:	-8.92(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]pyridin-3-yl]benzamide

Drug info:

PubChemData

Smile

C1COC(CN1C2=NC=CC=N2)C3=NC=C(C=C3)C4=CC=C(C=C4)C(=O)N

DOS

IR

Vibrations