Geometry & MOs

Info

ID:	266728
PubChem CID:	103579223
Reduced:	NOC15H19 (1)
Stoich.:	ABC15D19 (1)
Weight, g/mol:	208.067034
ΔH_f, kcal/mol:	-3.54
Dipole, Da:	3.75
IP(EA), eV:	-9.34(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-pent-1-yn-3-yl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCC(C#C)NC(=O)CCCC1=CC=CC=C1

DOS

IR

Vibrations