Geometry & MOs

Info

ID:	202878
PubChem CID:	79737522
Reduced:	O2N4C11H20 (1)
Stoich.:	A2B4C11D20 (1)
Weight, g/mol:	230.105528
ΔH_f, kcal/mol:	-20.02
Dipole, Da:	3.72
IP(EA), eV:	-8.94(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-[(1-methylimidazol-2-yl)methyl]benzoic acid

Drug info:

PubChemData

Smile

C1CN(CCC1OCCCN)CC2=NOC=N2

DOS

IR

Vibrations