Geometry & MOs

Info

ID:	391763
PubChem CID:	135009324
Reduced:	BrO9H29C32 (1)
Stoich.:	AB9C29D32 (1)
Weight, g/mol:	364.206986
ΔH_f, kcal/mol:	-288.29
Dipole, Da:	4.48
IP(EA), eV:	-9.28(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,3R)-3-[tert-butyl(dimethyl)silyl]oxy-6-[(4-methoxyphenyl)methoxy]hex-4-enal

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1CC2=C3C(=CC(=C2C(=O)OC)OC)C(=O)C4=CC=CC=C4C3=O)C(=O)C(CCCC(=O)OC)Br

DOS

IR

Vibrations