Geometry & MOs

Info

ID:	413701
PubChem CID:	135086651
Reduced:	NPO3C8H18 (1)
Stoich.:	ABC3D8E18 (1)
Weight, g/mol:	280.07302
ΔH_f, kcal/mol:	-191.83
Dipole, Da:	4.36
IP(EA), eV:	-9.95(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylselanyloct-6-yn-2-ylbenzene

Drug info:

PubChemData

Smile

CCC1CN1P(=O)(OCC)OCC

DOS

IR

Vibrations