Geometry & MOs

Info

ID:	46383
PubChem CID:	10524160
Reduced:	NSO2C23H31 (1)
Stoich.:	ABC2D23E31 (1)
Weight, g/mol:	384.019911
ΔH_f, kcal/mol:	-63.55
Dipole, Da:	3.75
IP(EA), eV:	-8.06(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5,6-trichloro-1-(2-phenylmethoxyethoxymethyl)benzimidazole

Drug info:

PubChemData

Smile

CCCCCCC1=CC2=C(S1)[C@@H]3[C@H](CCC4=CC(=C(C=C34)OC)OC)NC2

DOS

IR

Vibrations