Geometry & MOs

Info

ID:	22531
PubChem CID:	597534
Reduced:	NSH15C18 (1)
Stoich.:	ABC15D18 (1)
Weight, g/mol:	277.092521
ΔH_f, kcal/mol:	81.01
Dipole, Da:	1.31
IP(EA), eV:	-8.67(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzhydrylsulfanylpyridine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C2=CC=CC=C2)SC3=CC=CC=N3

DOS

IR

Vibrations