Geometry & MOs

Info

ID:	206289
PubChem CID:	80226532
Reduced:	OSN4C15H24 (1)
Stoich.:	ABC4D15E24 (1)
Weight, g/mol:	310.182733
ΔH_f, kcal/mol:	-26.13
Dipole, Da:	4.53
IP(EA), eV:	-8.64(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-[(tert-butylamino)methyl]-1,3-thiazol-2-yl]-1,3,3-trimethylpiperazin-2-one

Drug info:

PubChemData

Smile

CC1(C(=O)N(CCN1C2=NC3=C(S2)CCCC3NC)C)C

DOS

IR

Vibrations