Geometry & MOs

Info

ID:	205185
PubChem CID:	80066115
Reduced:	ION4C14H17 (1)
Stoich.:	ABC4D14E17 (1)
Weight, g/mol:	233.080041
ΔH_f, kcal/mol:	27.57
Dipole, Da:	4.08
IP(EA), eV:	-9.03(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-methoxypyridin-3-yl)methyl]-1H-imidazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CCCNC1=NC(=NC=C1I)CC2=CN=C(C=C2)OC

DOS

IR

Vibrations