Geometry & MOs

Info

ID:	62926
PubChem CID:	26737659
Reduced:	SN2O4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	388.145678
ΔH_f, kcal/mol:	-104.01
Dipole, Da:	1.78
IP(EA), eV:	-8.35(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-[2-[2-(4-ethoxyphenoxy)ethylsulfanyl]benzimidazol-1-yl]propane-1,2-diol

Drug info:

PubChemData

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CCOC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3N2C[C@H](CO)O

DOS

IR

Vibrations