Geometry & MOs

Info

ID:	412873
PubChem CID:	135085802
Reduced:	OC17H26 (1)
Stoich.:	AB17C26 (1)
Weight, g/mol:	264.01612
ΔH_f, kcal/mol:	-32.78
Dipole, Da:	3.25
IP(EA), eV:	-9.53(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(2-bromo-2-fluoroethenyl)-1,4-dioxaspiro[4.5]decane

Drug info:

PubChemData

Smile

CC(=C)[C@@H]1CC[C@](C(=O)[C@]1(C)CC=C)(C)CC=C

DOS

IR

Vibrations