Geometry & MOs

Info

ID:	416686
PubChem CID:	135090056
Reduced:	O2N3C19H27 (1)
Stoich.:	A2B3C19D27 (1)
Weight, g/mol:	347.232125
ΔH_f, kcal/mol:	-73.44
Dipole, Da:	3.53
IP(EA), eV:	-9.08(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[(6-ethyl-2-piperidin-1-ylpyrimidin-4-yl)amino]methyl]morpholin-4-yl]ethanone

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)CCCC(=O)N(CCO)CC2=NC=CN2

DOS

IR

Vibrations