Geometry & MOs

Info

ID:	261490
PubChem CID:	103235969
Reduced:	N2O2C11H24 (1)
Stoich.:	A2B2C11D24 (1)
Weight, g/mol:	340.9863
ΔH_f, kcal/mol:	-114.43
Dipole, Da:	7.12
IP(EA), eV:	-8.99(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-[(3,5-difluoroanilino)methyl]benzoic acid

Drug info:

PubChemData

Smile

CCCCC(C(=O)O)NCCCN(C)C

DOS

IR

Vibrations