Geometry & MOs

Info

ID:	339077
PubChem CID:	127260329
Reduced:	NO4C25H31 (1)
Stoich.:	AB4C25D31 (1)
Weight, g/mol:	367.178358
ΔH_f, kcal/mol:	-153.76
Dipole, Da:	12.05
IP(EA), eV:	-8.68(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[cyclopentyl(propyl)amino]-2-hydroxybenzoyl]benzoic acid

Drug info:

PubChemData

Smile

CCCCCN(C1CCCCC1)C2=CC(=C(C=C2)C(=O)C3=CC=CC=C3C(=O)O)O

DOS

IR

Vibrations