Geometry & MOs

Info

ID:	14359
PubChem CID:	410102
Reduced:	SN2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	306.097289
ΔH_f, kcal/mol:	67.17
Dipole, Da:	3.03
IP(EA), eV:	-8.93(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)phenyl]methylsulfanyl]-4,5-dihydro-1H-imidazole

Drug info:

PubChemData

Smile

C1CN=C(N1)SCC2=CC=C(C=C2)CSC3=NCCN3

DOS

IR

Vibrations