Geometry & MOs

Info

ID:	322442
PubChem CID:	126670175
Reduced:	NO2C16H29 (1)
Stoich.:	AB2C16D29 (1)
Weight, g/mol:	297.212636
ΔH_f, kcal/mol:	-127.74
Dipole, Da:	4.91
IP(EA), eV:	-9.17(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(7-methyltridecan-7-yl)-3H-1,3-thiazol-2-one

Drug info:

PubChemData

Smile

CCCCCCC(C)(CCCCC)C1=CNC(=O)O1

DOS

IR

Vibrations