Geometry & MOs

Info

ID:	126562
PubChem CID:	50968115
Reduced:	SO2N3C19H25 (1)
Stoich.:	AB2C3D19E25 (1)
Weight, g/mol:	330.159295
ΔH_f, kcal/mol:	-55.9
Dipole, Da:	4.77
IP(EA), eV:	-8.38(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[5-(5-methyl-1H-imidazol-2-yl)-4-phenylimidazol-1-yl]ethyl]pyrazine

Drug info:

PubChemData

Smile

CC1=CC(=NC2=C1C=CC(=C2)SC)NCC3CC(=O)N(C3)CCOC

DOS

IR

Vibrations