Geometry & MOs

Info

ID:	265114
PubChem CID:	103510655
Reduced:	NOC5H5 (3)
Stoich.:	ABC5D5 (3)
Weight, g/mol:	260.09094
ΔH_f, kcal/mol:	-68.73
Dipole, Da:	2.91
IP(EA), eV:	-9.24(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(3-methylimidazole-4-carbonyl)amino]methyl]pyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CN1C=NC=C1C(=O)N2CCC(C3=CC=CC=C32)C(=O)O

DOS

IR

Vibrations