Geometry & MOs

Info

ID:	409975
PubChem CID:	135082762
Reduced:	SSeC6H11 (2)
Stoich.:	ABC6D11 (2)
Weight, g/mol:	307.082265
ΔH_f, kcal/mol:	19.53
Dipole, Da:	1.99
IP(EA), eV:	-8.43(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,6S,6aR)-4-chloro-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-4-nitroso-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole

Drug info:

PubChemData

Smile

CCCCSC(=C)[Se][Se]C(=C)SCCCC

DOS

IR

Vibrations