Geometry & MOs

Info

ID:	404529
PubChem CID:	135066686
Reduced:	OC14H24 (1)
Stoich.:	AB14C24 (1)
Weight, g/mol:	528.283961
ΔH_f, kcal/mol:	-84.85
Dipole, Da:	1.95
IP(EA), eV:	-9.15(1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S,7R,9R,11S)-4,7-bis[[tert-butyl(dimethyl)silyl]oxy]-13-isocyano-8-oxo-15-oxatetracyclo[7.5.1.01,11.02,7]pentadec-4-ene-13-carbonitrile

Drug info:

PubChemData

Smile

CC(C)(C)C1CC=C2CCC[C@H]([C@H]2C1)O

DOS

IR

Vibrations