Geometry & MOs

Info

ID:	200302
PubChem CID:	79376423
Reduced:	SN4C13H22 (1)
Stoich.:	AB4C13D22 (1)
Weight, g/mol:	248.109568
ΔH_f, kcal/mol:	33.4
Dipole, Da:	7.01
IP(EA), eV:	-8.85(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylamino)-3-methyl-1,2-thiazole-4-carbonitrile

Drug info:

PubChemData

Smile

CC1=NSC(=C1C#N)NC(CC(C)C)CN(C)C

DOS

IR

Vibrations