Geometry & MOs

Info

ID:	394773
PubChem CID:	135023740
Reduced:	NO2C16H21 (1)
Stoich.:	AB2C16D21 (1)
Weight, g/mol:	305.098669
ΔH_f, kcal/mol:	-44.85
Dipole, Da:	1.66
IP(EA), eV:	-8.87(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-5-(4-methylphenyl)-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazole

Drug info:

PubChemData

Smile

CC(C)(C)C=C=CN(CC1=CC=CC=C1)C(=O)OC

DOS

IR

Vibrations