Geometry & MOs

Info

ID:	127845
PubChem CID:	51019401
Reduced:	O3C17H24 (1)
Stoich.:	A3B17C24 (1)
Weight, g/mol:	252.11503
ΔH_f, kcal/mol:	-152.63
Dipole, Da:	2.65
IP(EA), eV:	-9.19(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,10S)-1-methyl-17-oxatetracyclo[8.6.1.02,7.011,16]heptadeca-2,4,6,11,13,15-hexaen-10-ol

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H]([C@H]2[C@@H]3[C@@H]1[C@@H](C=C2C)C(=O)C3(C)C)OC(=O)C

DOS

IR

Vibrations