Geometry & MOs

Info

ID:	430374
PubChem CID:	135170438
Reduced:	ON2C19H28 (1)
Stoich.:	AB2C19D28 (1)
Weight, g/mol:	213.9547
ΔH_f, kcal/mol:	-30.11
Dipole, Da:	4.73
IP(EA), eV:	-8.83(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenylethynylphosphanium;bromide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=C(C)C)CNCCCNC(=O)C(=C)C

DOS

IR

Vibrations