Geometry & MOs

Info

ID:	253122
PubChem CID:	103116186
Reduced:	ON4C12H14 (1)
Stoich.:	AB4C12D14 (1)
Weight, g/mol:	260.09094
ΔH_f, kcal/mol:	21.53
Dipole, Da:	7.15
IP(EA), eV:	-8.46(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-[(1-methylpyrazole-3-carbonyl)amino]benzoic acid

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)NCC2=CC(=CC=C2)N

DOS

IR

Vibrations