Geometry & MOs

Info

ID:	287022
PubChem CID:	104231701
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-48.02
Dipole, Da:	3.53
IP(EA), eV:	-8.94(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[2-(4,5-dimethylimidazol-1-yl)-6-methoxyphenyl]ethanol

Drug info:

PubChemData

Smile

CC1=C(N(C=N1)C2=C(C(=CC=C2)OC)C(C)O)C

DOS

IR

Vibrations