Geometry & MOs

Info

ID:	43128
PubChem CID:	10318860
Reduced:	NF2O3C23H25 (1)
Stoich.:	AB2C3D23E25 (1)
Weight, g/mol:	401.13734
ΔH_f, kcal/mol:	-183.32
Dipole, Da:	2.34
IP(EA), eV:	-9.12(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-bis(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CN1[C@@H]2CC[C@H]1[C@H]([C@@H](C2)OC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)C(=O)OC

DOS

IR

Vibrations