Geometry & MOs

Info

ID:	412218
PubChem CID:	135085101
Reduced:	OSC7H13 (2)
Stoich.:	ABC7D13 (2)
Weight, g/mol:	244.131074
ΔH_f, kcal/mol:	-96.64
Dipole, Da:	0.59
IP(EA), eV:	-8.21(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-hydroxy-2-pent-4-enoxyoxan-3-yl) acetate

Drug info:

PubChemData

Smile

C1CCC(CC1)S(=O)CCS(=O)C2CCCCC2

DOS

IR

Vibrations