Geometry & MOs

Info

ID:	392783
PubChem CID:	135017947
Reduced:	NO2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	580.434314
ΔH_f, kcal/mol:	-155.66
Dipole, Da:	2.18
IP(EA), eV:	-8.67(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E,4R)-4-[(1R,2S)-2-[(E,6R)-6-[tert-butyl(dimethyl)silyl]oxyhept-1-enyl]cyclopentyl]-4-tri(propan-2-yl)silyloxybut-2-enoate

Drug info:

PubChemData

Smile

CCOC1C2=CC=CC=C2C3=CC=CC=C3N1C(=O)CNC(=O)OC(C)(C)C

DOS

IR

Vibrations