Geometry & MOs

Info

ID:	271376
PubChem CID:	103671261
Reduced:	NCl2O2C13H17 (1)
Stoich.:	AB2C2D13E17 (1)
Weight, g/mol:	304.124549
ΔH_f, kcal/mol:	-92.11
Dipole, Da:	2.62
IP(EA), eV:	-9.41(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-phenyl-1,3-thiazol-2-yl)methylamino]oxan-4-yl]methanol

Drug info:

PubChemData

Smile

C1COCCC1(CO)NCC2=CC(=CC(=C2)Cl)Cl

DOS

IR

Vibrations