Geometry & MOs

Info

ID:	200272
PubChem CID:	79374984
Reduced:	OSN2C16H20 (1)
Stoich.:	ABC2D16E20 (1)
Weight, g/mol:	209.098669
ΔH_f, kcal/mol:	6.64
Dipole, Da:	2.26
IP(EA), eV:	-8.67(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,2-dimethylpropylamino)-3-methyl-1,2-thiazole-4-carbonitrile

Drug info:

PubChemData

Smile

CC(C)NC1(CCC2=C1C=C(C=C2)OC)C3=NC=CS3

DOS

IR

Vibrations