Geometry & MOs

Info

ID:	404695
PubChem CID:	135069671
Reduced:	NSSiO2C14H23 (1)
Stoich.:	ABCD2E14F23 (1)
Weight, g/mol:	262.156895
ΔH_f, kcal/mol:	-81.71
Dipole, Da:	4.27
IP(EA), eV:	-9.2(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl (1R,2S,6R,7S)-3-methyl-5-oxotricyclo[5.2.1.02,6]dec-3-ene-4-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2CN2S(=O)(=O)CC[Si](C)(C)C

DOS

IR

Vibrations