Geometry & MOs

Info

ID:	203278
PubChem CID:	79807323
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	275.126991
ΔH_f, kcal/mol:	-171.65
Dipole, Da:	4.59
IP(EA), eV:	-9.85(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-(1H-indazole-6-carbonylamino)butanoic acid

Drug info:

PubChemData

Smile

CCC(CC)(C(=O)O)NC(=O)C1=CC(=CN1C)C(=O)C

DOS

IR

Vibrations