Geometry & MOs

Info

ID:	206874
PubChem CID:	80314855
Reduced:	SN3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	283.135448
ΔH_f, kcal/mol:	8.29
Dipole, Da:	2.15
IP(EA), eV:	-8.7(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]piperazine-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CSC(=N1)CN2CCCC(C2)C(C)N

DOS

IR

Vibrations