Geometry & MOs

Info

ID:	292893
PubChem CID:	117362541
Reduced:	O3C15H16 (1)
Stoich.:	A3B15C16 (1)
Weight, g/mol:	244.121178
ΔH_f, kcal/mol:	-87.56
Dipole, Da:	3.77
IP(EA), eV:	-8.39(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(1-methylimidazol-2-yl)methyl]phenyl]propanoic acid

Drug info:

PubChemData

Smile

CC(=O)CC1=C(C2=CC=CC=C2C(=C1)OC)OC

DOS

IR

Vibrations