Geometry & MOs

Info

ID:	287677
PubChem CID:	104251570
Reduced:	NO3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	240.129634
ΔH_f, kcal/mol:	-112.75
Dipole, Da:	3.81
IP(EA), eV:	-8.65(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methyl-1,3-thiazol-2-yl)-3-(oxan-2-yl)propan-2-amine

Drug info:

PubChemData

Smile

C1CCOC(C1)CC(C2=CC3=C(C=C2)OCCO3)N

DOS

IR

Vibrations