Geometry & MOs

Info

ID:	277277
PubChem CID:	103827596
Reduced:	SN3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	250.135114
ΔH_f, kcal/mol:	67.43
Dipole, Da:	3.44
IP(EA), eV:	-8.96(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(2-ethylsulfonylethyl)-3,3-dimethylbutanamide

Drug info:

PubChemData

Smile

C#CCSCCNC1=NC=NC2=C1CCCCC2

DOS

IR

Vibrations