Geometry & MOs

Info

ID:	394181
PubChem CID:	135022483
Reduced:	O3C19H24 (1)
Stoich.:	A3B19C24 (1)
Weight, g/mol:	413.164046
ΔH_f, kcal/mol:	-88.28
Dipole, Da:	2.47
IP(EA), eV:	-9.76(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-phenyl-2-[2-(4-phenyltriazol-1-yl)phenyl]imidazo[1,2-a]pyridine

Drug info:

PubChemData

Smile

CCOC(=O)/C=C/C=C/[C@H]1C[C@@H]2CC(=O)[C@]1(C=C2)CCC=C

DOS

IR

Vibrations