Geometry & MOs

Info

ID:	206965
PubChem CID:	80324983
Reduced:	BrSN2C16H21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	309.151098
ΔH_f, kcal/mol:	28.94
Dipole, Da:	3.7
IP(EA), eV:	-8.86(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-diethyl-6,6-dimethyl-1-[(4-methyl-1,3-thiazol-2-yl)methyl]piperazine-2,5-dione

Drug info:

PubChemData

Smile

CCNCC(CC1=NC(=C(S1)C)C)C2=CC=CC=C2Br

DOS

IR

Vibrations