Geometry & MOs

Info

ID:	218810
PubChem CID:	85090010
Reduced:	SN4O6C25H26 (1)
Stoich.:	AB4C6D25E26 (1)
Weight, g/mol:	512.298942
ΔH_f, kcal/mol:	-159.94
Dipole, Da:	4.81
IP(EA), eV:	-9.01(-2.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 7-[tert-butyl(dimethyl)silyl]oxy-4-(2-ethoxy-2-trimethylsilyloxyethenylidene)-6-(2-methyloxiran-2-yl)non-8-enoate

Drug info:

PubChemData

Smile

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)SC2=C3C(=NC(=NC3=O)N)C=CC2=C

DOS

IR

Vibrations