Geometry & MOs

Info

ID:	409584
PubChem CID:	135082366
Reduced:	BiClSO2C17H20 (1)
Stoich.:	ABCD2E17F20 (1)
Weight, g/mol:	427.157445
ΔH_f, kcal/mol:	-36.42
Dipole, Da:	7.11
IP(EA), eV:	-9.45(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethynylbenzene;gold(1+);octan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[Bi](C2=CC=C(C=C2)S(=O)(=O)C(C)(C)C)Cl

DOS

IR

Vibrations