Geometry & MOs

Info

ID:	258304
PubChem CID:	103152791
Reduced:	ON2F3C11H19 (1)
Stoich.:	AB2C3D11E19 (1)
Weight, g/mol:	316.00587
ΔH_f, kcal/mol:	-203.21
Dipole, Da:	1.43
IP(EA), eV:	-9.17(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-bromopyridine-3-carbonyl)amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

COC(CCN1CCC(=CC1)C(F)(F)F)CN

DOS

IR

Vibrations