Geometry & MOs

Info

ID:	253192
PubChem CID:	103116691
Reduced:	N3O3C15H19 (1)
Stoich.:	A3B3C15D19 (1)
Weight, g/mol:	241.106256
ΔH_f, kcal/mol:	-87.4
Dipole, Da:	8.79
IP(EA), eV:	-9.26(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-2-[(1-methylpyrazole-3-carbonyl)amino]butanoic acid

Drug info:

PubChemData

Smile

CC(C)C[C@H](C(=O)O)NC(=O)C1=NN(C2=CC=CC=C21)C

DOS

IR

Vibrations