Geometry & MOs

Info

ID:	281389
PubChem CID:	103913799
Reduced:	SN2O2C14H28 (1)
Stoich.:	AB2C2D14E28 (1)
Weight, g/mol:	262.08097
ΔH_f, kcal/mol:	-124.02
Dipole, Da:	5.96
IP(EA), eV:	-8.34(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylsulfonyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(C)CN1CCC(CC1)NC2CCCS(=O)(=O)C2

DOS

IR

Vibrations