Geometry & MOs

Info

ID:	309577
PubChem CID:	126549262
Reduced:	NO2C18H27 (1)
Stoich.:	AB2C18D27 (1)
Weight, g/mol:	195.108171
ΔH_f, kcal/mol:	-118.68
Dipole, Da:	4.66
IP(EA), eV:	-8.39(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethenyl-5-(2-methylpentan-2-yl)-1,3-thiazole

Drug info:

PubChemData

Smile

CC1(CCCCC1)NC2=CC=C(C=C2)C(=O)OC(C)(C)C

DOS

IR

Vibrations