Geometry & MOs

Info

ID:	411768
PubChem CID:	135084602
Reduced:	F2O2C13H14 (1)
Stoich.:	A2B2C13D14 (1)
Weight, g/mol:	314.99286
ΔH_f, kcal/mol:	-167.69
Dipole, Da:	2.72
IP(EA), eV:	-9.43(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromophenyl)-N,N-diethylethynesulfonamide

Drug info:

PubChemData

Smile

CCOC(=O)CCC1=CC=C(C=C1)C=C(F)F

DOS

IR

Vibrations