Geometry & MOs

Info

ID:	388144
PubChem CID:	134988323
Reduced:	FSSeC4H7 (1)
Stoich.:	ABCD4E7 (1)
Weight, g/mol:	204.136159
ΔH_f, kcal/mol:	-28.19
Dipole, Da:	3.71
IP(EA), eV:	-9.01(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(4-methoxybutoxy)-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(C)[Se]C(=S)F

DOS

IR

Vibrations