Geometry & MOs

Info

ID:	390400
PubChem CID:	134998977
Reduced:	O4C17H24 (1)
Stoich.:	A4B17C24 (1)
Weight, g/mol:	495.246832
ΔH_f, kcal/mol:	-181.3
Dipole, Da:	1.6
IP(EA), eV:	-9.34(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(13S,15R)-2,6,9,11,13,15-hexahydroxy-1,5,10-trimethyl-11-propan-2-yl-8-oxatetracyclo[7.4.1.17,10.02,7]pentadecan-12-yl] 1H-pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)CC1(CCCC(O1)CC2=CC=CC=C2)OC

DOS

IR

Vibrations