Geometry & MOs

Info

ID:	393290
PubChem CID:	135019994
Reduced:	BrOSiC20H25 (1)
Stoich.:	ABCD20E25 (1)
Weight, g/mol:	250.120509
ΔH_f, kcal/mol:	-49.01
Dipole, Da:	1.55
IP(EA), eV:	-8.57(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4R)-4-but-3-enoyloxyhexa-1,5-dien-3-yl] but-3-enoate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)O/C(=C\C1=CC=CC=C1)/C2=CC=C(C=C2)Br

DOS

IR

Vibrations