Geometry & MOs

Info

ID:	240991
PubChem CID:	93619107
Reduced:	N3O3C11H15 (1)
Stoich.:	A3B3C11D15 (1)
Weight, g/mol:	225.111341
ΔH_f, kcal/mol:	-85.55
Dipole, Da:	5.66
IP(EA), eV:	-8.96(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[4-(2-methylpropanoylamino)pyrazol-1-yl]propanoic acid

Drug info:

PubChemData

Smile

C[C@H](C(=O)O)N1C=C(C=N1)NC(=O)C2CCC2

DOS

IR

Vibrations