Geometry & MOs

Info

ID:	226756
PubChem CID:	87558127
Reduced:	PC18H23 (1)
Stoich.:	AB18C23 (1)
Weight, g/mol:	310.128589
ΔH_f, kcal/mol:	15.0
Dipole, Da:	1.78
IP(EA), eV:	-8.57(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2-[(1-methyl-4-propylimidazol-2-yl)disulfanyl]-4-propylimidazole

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1C2=CC=CC=C2)C)P)C(C)(C)C

DOS

IR

Vibrations