Geometry & MOs

Info

ID:	250550
PubChem CID:	103097469
Reduced:	SN3C10H15 (1)
Stoich.:	AB3C10D15 (1)
Weight, g/mol:	209.098669
ΔH_f, kcal/mol:	41.2
Dipole, Da:	4.08
IP(EA), eV:	-9.5(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-aminopropyl)-1,3-thiazol-2-yl]-2-methylpropanenitrile

Drug info:

PubChemData

Smile

CC(CN)C1=CSC(=N1)C(C)(C)C#N

DOS

IR

Vibrations