Geometry & MOs

Info

ID:	312241
PubChem CID:	126603810
Reduced:	OH2C3 (3)
Stoich.:	AB2C3 (3)
Weight, g/mol:	382.271924
ΔH_f, kcal/mol:	-5.84
Dipole, Da:	4.49
IP(EA), eV:	-9.98(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-methoxy-3-methyloct-1-enyl]cyclopentyl]hept-5-enoic acid

Drug info:

PubChemData

Smile

C1C=C=C=CC2C1C(=O)OC2=O

DOS

IR

Vibrations