Geometry & MOs

Info

ID:	261789
PubChem CID:	103250876
Reduced:	N2O3C11H20 (1)
Stoich.:	A2B3C11D20 (1)
Weight, g/mol:	337.06774
ΔH_f, kcal/mol:	-156.61
Dipole, Da:	7.72
IP(EA), eV:	-10.01(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-bicyclo[2.2.1]heptanylmethylamino)methyl]-3-bromobenzoic acid

Drug info:

PubChemData

Smile

CCCCC(C(=O)O)NC1CCC(=O)NC1

DOS

IR

Vibrations