Geometry & MOs

Info

ID:	200399
PubChem CID:	79381851
Reduced:	OSN3C16H29 (1)
Stoich.:	ABC3D16E29 (1)
Weight, g/mol:	323.164303
ΔH_f, kcal/mol:	-49.57
Dipole, Da:	2.18
IP(EA), eV:	-8.3(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-4-propan-2-yl-5-(propylaminomethyl)-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CCNCC1=C(N=C(S1)N(C)CC2CCCOC2)C(C)C

DOS

IR

Vibrations