Geometry & MOs

Info

ID:	208694
PubChem CID:	80567654
Reduced:	N3C17H27 (1)
Stoich.:	A3B17C27 (1)
Weight, g/mol:	242.108899
ΔH_f, kcal/mol:	9.73
Dipole, Da:	2.21
IP(EA), eV:	-8.24(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[ethyl(propan-2-yl)amino]-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CCC(C)N1CCN(CC1)CC2CC3=CC=CC=C3N2

DOS

IR

Vibrations