Geometry & MOs

Info

ID:	332203
PubChem CID:	127250489
Reduced:	O2N5C22H23 (1)
Stoich.:	A2B5C22D23 (1)
Weight, g/mol:	389.185175
ΔH_f, kcal/mol:	-3.49
Dipole, Da:	4.68
IP(EA), eV:	-8.85(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)N2CCOC(C2)C3=CC=CC(=N3)C4=CC(=CC=C4)C(=O)N)C

DOS

IR

Vibrations