Geometry & MOs

Info

ID:	223458
PubChem CID:	85335072
Reduced:	S2O3N4C15H22 (1)
Stoich.:	A2B3C4D15E22 (1)
Weight, g/mol:	370.271924
ΔH_f, kcal/mol:	-57.25
Dipole, Da:	6.65
IP(EA), eV:	-8.88(-2.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydroxypropyl 10-oxooctadec-8-enoate

Drug info:

PubChemData

Smile

CC1CCC(N1CC(CNS(=O)(=O)C2=CC=CC3=NSN=C32)O)C

DOS

IR

Vibrations