Geometry & MOs

Info

ID:	126343
PubChem CID:	50960666
Reduced:	ClON5C11H14 (1)
Stoich.:	ABC5D11E14 (1)
Weight, g/mol:	361.157246
ΔH_f, kcal/mol:	19.93
Dipole, Da:	9.96
IP(EA), eV:	-8.84(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)methyl]-2-morpholin-4-ylpyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

C1CN2CCN(CC2C(=O)N1)C3=NN=C(C=C3)Cl

DOS

IR

Vibrations