Geometry & MOs

Info

ID:	213595
PubChem CID:	81064341
Reduced:	NO3C14H25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	398.89624
ΔH_f, kcal/mol:	-181.15
Dipole, Da:	3.21
IP(EA), eV:	-9.81(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4,5-dibromothiophene-2-carbonyl)amino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)CC1CCCCC1

DOS

IR

Vibrations