Geometry & MOs

Info

ID:	338308
PubChem CID:	127259000
Reduced:	NO4C17H23 (1)
Stoich.:	AB4C17D23 (1)
Weight, g/mol:	276.028846
ΔH_f, kcal/mol:	-120.95
Dipole, Da:	5.81
IP(EA), eV:	-9.81(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl hexanediimidothioate;dihydrochloride

Drug info:

PubChemData

Smile

C1CCC(C1)CC(CO)C(=O)NOCC2=CC=CC=C2C=O

DOS

IR

Vibrations