Geometry & MOs

Info

ID:	68515
PubChem CID:	46508566
Reduced:	F2N2O3C18H18 (1)
Stoich.:	A2B2C3D18E18 (1)
Weight, g/mol:	359.130363
ΔH_f, kcal/mol:	-156.46
Dipole, Da:	1.97
IP(EA), eV:	-8.84(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[[(3,4-dimethoxyphenyl)methyl-ethylamino]methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Drug info:

PubChemData

Smile

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=C(C=C(C=C3)F)F

DOS

IR

Vibrations