Geometry & MOs

Info

ID:	386380
PubChem CID:	134981571
Reduced:	BrNOC13H20 (1)
Stoich.:	ABCD13E20 (1)
Weight, g/mol:	334.041222
ΔH_f, kcal/mol:	-53.93
Dipole, Da:	3.88
IP(EA), eV:	-10.29(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

chloro-[(E)-hept-3-en-3-yl]mercury

Drug info:

PubChemData

Smile

C[C@]12CC[C@@H](C([C@@H]1CC[C@H](O2)C#N)(C)C)Br

DOS

IR

Vibrations