Geometry & MOs

Info

ID:	150051
PubChem CID:	53789736
Reduced:	SN2O5C45H90 (1)
Stoich.:	AB2C5D45E90 (1)
Weight, g/mol:	248.141244
ΔH_f, kcal/mol:	-334.3
Dipole, Da:	4.74
IP(EA), eV:	-8.8(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-oxatetracyclo[6.2.1.02,7.03,5]undecan-10-ylmethyl 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CCCCCCCCC=CCCCCCCCCOCC(COCCCCCCCCC=CCCCCCCCC)OS(=O)(=O)NCCN(CC)CC

DOS

IR

Vibrations