Geometry & MOs

Info

ID:	203210
PubChem CID:	79792470
Reduced:	N2F3O3C13H21 (1)
Stoich.:	A2B3C3D13E21 (1)
Weight, g/mol:	299.01571
ΔH_f, kcal/mol:	-314.62
Dipole, Da:	8.26
IP(EA), eV:	-10.07(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-bromobenzoyl)amino]-2-methylbutanoic acid

Drug info:

PubChemData

Smile

CCCC1(CCN(CC1)C(=O)C(C)(C(F)(F)F)N)C(=O)O

DOS

IR

Vibrations