Geometry & MOs

Info

ID:

25275

PubChem CID:

622113

Reduced:

NO3H11C16 (1)

Stoich.:

AB3C11D16 (1)

Weight, g/mol:

374.101037

ΔHf, kcal/mol:

26.69

Dipole, Da:

6.93

IP(EA), eV:

-9.26(-1.46)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,2-dimethyl-4-phenylsulfanyl-6-(phenylsulfanylmethyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC2=CC=C(C3=CC=CC=C32)[N+](=O)[O-]

DOS

IR

Vibrations