Geometry & MOs

Info

ID:	284350
PubChem CID:	104045748
Reduced:	NO3C15H31 (1)
Stoich.:	AB3C15D31 (1)
Weight, g/mol:	380.98817
ΔH_f, kcal/mol:	-182.46
Dipole, Da:	3.6
IP(EA), eV:	-9.19(1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,6-dimethyloxan-4-yl) 5-bromo-4-sulfamoylfuran-2-carboxylate

Drug info:

PubChemData

Smile

CCNC(C)(CCCOC1CC(OC(C1)C)C)CO

DOS

IR

Vibrations