Geometry & MOs

Info

ID:	253241
PubChem CID:	103116991
Reduced:	N3O3C11H17 (1)
Stoich.:	A3B3C11D17 (1)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-103.41
Dipole, Da:	4.23
IP(EA), eV:	-9.75(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-[(1-methylindazole-3-carbonyl)amino]butanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)N(CC(=O)O)C(=O)C1=NN(C=C1)C

DOS

IR

Vibrations