Geometry & MOs

Info

ID:	407842
PubChem CID:	135080597
Reduced:	OSN2H10C13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	268.03664
ΔH_f, kcal/mol:	71.28
Dipole, Da:	0.36
IP(EA), eV:	-8.81(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-phenylselanylhept-6-yn-1-ol

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C2=[N+](C3=CC=CC=C3N=C2)[O-]

DOS

IR

Vibrations