Geometry & MOs

Info

ID:	389932
PubChem CID:	134996103
Reduced:	FO2C14H15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	164.01387
ΔH_f, kcal/mol:	-104.26
Dipole, Da:	1.4
IP(EA), eV:	-8.62(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-5,5,6,6-tetradeuteriohex-2-yne

Drug info:

PubChemData

Smile

CC(CO)(C1=CC=CC2=C1C=CC(=C2)OC)F

DOS

IR

Vibrations