Geometry & MOs

Info

ID:	77376
PubChem CID:	48427246
Reduced:	NO2C18H25 (1)
Stoich.:	AB2C18D25 (1)
Weight, g/mol:	328.124549
ΔH_f, kcal/mol:	-37.77
Dipole, Da:	3.36
IP(EA), eV:	-9.38(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4,5-dimethyl-2-oxo-1,3-thiazol-3-yl)-N-[(4-methylphenyl)methyl]-N-prop-2-ynylacetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN(CC#C)C(=O)CCOCC(C)C

DOS

IR

Vibrations