Geometry & MOs

Info

ID:	306124
PubChem CID:	125001689
Reduced:	FO2N5C21H22 (1)
Stoich.:	AB2C5D21E22 (1)
Weight, g/mol:	324.125612
ΔH_f, kcal/mol:	-45.69
Dipole, Da:	3.81
IP(EA), eV:	-9.49(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-methyl-2-[4-(1,3-thiazol-2-yl)piperazine-1-carbonyl]morpholine-4-carbaldehyde

Drug info:

PubChemData

Smile

CNC(=O)C1=C2N=CC=C(N2N=C1)[C@H]3CCCCN3C(=O)CC4=CC=C(C=C4)F

DOS

IR

Vibrations