Geometry & MOs

Info

ID:	213880
PubChem CID:	81065511
Reduced:	N3O3C15H25 (1)
Stoich.:	A3B3C15D25 (1)
Weight, g/mol:	312.114378
ΔH_f, kcal/mol:	-137.95
Dipole, Da:	2.14
IP(EA), eV:	-8.96(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(thiophene-2-carbonylamino)propanoylamino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)CCC1=C(N(N=C1C)C)C

DOS

IR

Vibrations