Geometry & MOs

Info

ID:	253161
PubChem CID:	103116434
Reduced:	O2N6C13H18 (1)
Stoich.:	A2B6C13D18 (1)
Weight, g/mol:	254.101505
ΔH_f, kcal/mol:	-0.28
Dipole, Da:	4.65
IP(EA), eV:	-9.12(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=CN=C1C2=C(N=NN2CCN3CCCC3)C(=O)O

DOS

IR

Vibrations