Geometry & MOs

Info

ID:	287065
PubChem CID:	104231744
Reduced:	NOC8H10 (2)
Stoich.:	ABC8D10 (2)
Weight, g/mol:	272.152478
ΔH_f, kcal/mol:	-47.87
Dipole, Da:	3.58
IP(EA), eV:	-8.86(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[2-methoxy-6-(4,5,6,7-tetrahydrobenzimidazol-1-yl)phenyl]ethanol

Drug info:

PubChemData

Smile

C[C@H](C1=C(C=CC=C1OC)N2C=NC3=C2CCCC3)O

DOS

IR

Vibrations