Geometry & MOs

Info

ID:	305879
PubChem CID:	124972503
Reduced:	O2N5C14H19 (1)
Stoich.:	A2B5C14D19 (1)
Weight, g/mol:	303.151767
ΔH_f, kcal/mol:	-22.51
Dipole, Da:	5.49
IP(EA), eV:	-9.05(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-[(3R)-1-ethylpyrrolidin-3-yl]-2-methylpyrimidin-4-yl]-5-methyl-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)C(=O)N2CCO[C@@H](C2)C3=NC=C(N3)C

DOS

IR

Vibrations