Geometry & MOs

Info

ID:	181401
PubChem CID:	76743053
Reduced:	FN3O8C20H24 (1)
Stoich.:	AB3C8D20E24 (1)
Weight, g/mol:	390.313395
ΔH_f, kcal/mol:	-347.47
Dipole, Da:	5.67
IP(EA), eV:	-9.53(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,9,10,12,14,15,17,17-nonamethyl-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-ene-1,11-diol

Drug info:

PubChemData

Smile

CC(=O)OC(C1C(=O)N(CCO1)C2=CC(=CC(=C2)C(=O)N(C)CC(=O)N(C)C)F)C(=O)O

DOS

IR

Vibrations