Geometry & MOs

Info

ID:	384681
PubChem CID:	134977454
Reduced:	SN3O6H25C28 (1)
Stoich.:	AB3C6D25E28 (1)
Weight, g/mol:	422.0799
ΔH_f, kcal/mol:	-60.62
Dipole, Da:	15.36
IP(EA), eV:	-9.74(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bromo-cyclohex-3-en-1-yl-triphenyl-lambda5-phosphane

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC[C@H](N([C@H]1C2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)[N+](=O)[O-]

DOS

IR

Vibrations