Geometry & MOs

Info

ID:	276402
PubChem CID:	103823046
Reduced:	SN2O4C16H32 (1)
Stoich.:	AB2C4D16E32 (1)
Weight, g/mol:	276.09662
ΔH_f, kcal/mol:	-225.02
Dipole, Da:	5.2
IP(EA), eV:	-9.22(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-(2-ethylsulfonylethyl)ethanamine

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(C)CC1CCCN1C(=O)OC(C)(C)C

DOS

IR

Vibrations