Geometry & MOs

Info

ID:	213764
PubChem CID:	81064915
Reduced:	N3O4C13H19 (1)
Stoich.:	A3B4C13D19 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	-167.38
Dipole, Da:	6.79
IP(EA), eV:	-9.8(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1H-indole-5-carbonylamino)methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)C1=C(C(=NNC1=O)C)C

DOS

IR

Vibrations