Geometry & MOs

Info

ID:	186152
PubChem CID:	77396491
Reduced:	N3O6C17H19 (1)
Stoich.:	A3B6C17D19 (1)
Weight, g/mol:	470.321622
ΔH_f, kcal/mol:	-213.83
Dipole, Da:	2.91
IP(EA), eV:	-10.06(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[3-[tert-butyl(dimethyl)silyl]oxy-5-phenylpentyl]-9-methyl-3,4,7,7a,8,9,10,10a-octahydrocyclopenta[b]oxonin-2-one

Drug info:

PubChemData

Smile

CC1N(C(=O)O1)CC(=O)N2CC(CC2C(=O)O)NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations