Geometry & MOs

Info

ID:	182322
PubChem CID:	76874758
Reduced:	ON3C7H17 (1)
Stoich.:	AB3C7D17 (1)
Weight, g/mol:	196.067034
ΔH_f, kcal/mol:	-25.55
Dipole, Da:	2.37
IP(EA), eV:	-8.94(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)CCNCC(=NO)N

DOS

IR

Vibrations