Geometry & MOs

Info

ID:	226636
PubChem CID:	87550945
Reduced:	SN2O7C20H38 (1)
Stoich.:	AB2C7D20E38 (1)
Weight, g/mol:	180.00272
ΔH_f, kcal/mol:	-335.03
Dipole, Da:	7.72
IP(EA), eV:	-8.4(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-2,3-bis(sulfanyl)butanediamide

Drug info:

PubChemData

Smile

CCCCCCCCOS(=O)(=O)[O-].CCC(C)OCCOC(=O)CC1=[N+](C=CN1)C

DOS

IR

Vibrations