Geometry & MOs

Info

ID:	182920
PubChem CID:	76955057
Reduced:	O2C27H38 (1)
Stoich.:	A2B27C38 (1)
Weight, g/mol:	422.285236
ΔH_f, kcal/mol:	-65.43
Dipole, Da:	2.37
IP(EA), eV:	-9.17(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-oxo-3-tri(propan-2-yl)silyloxycyclohex-2-en-1-ylidene]butyl 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CC(=CCCC1(CC1C(C#CCCCC2=CC=CC=C2)OC(=O)C(C)(C)C)C)C

DOS

IR

Vibrations