Geometry & MOs

Info

ID:	201518
PubChem CID:	79550114
Reduced:	FCl2C17H21 (1)
Stoich.:	AB2C17D21 (1)
Weight, g/mol:	266.075885
ΔH_f, kcal/mol:	-56.65
Dipole, Da:	4.12
IP(EA), eV:	-9.94(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-2-methyl-N-(2-methyl-2-methylsulfonylpropyl)-3-sulfanylidenepropanamide

Drug info:

PubChemData

Smile

C1CC2CC1CC2CC(CCl)(CCl)C3=CC=CC=C3F

DOS

IR

Vibrations