Geometry & MOs

Info

ID:	282430
PubChem CID:	103926503
Reduced:	FNSO3C15H20 (1)
Stoich.:	ABCD3E15F20 (1)
Weight, g/mol:	278.163043
ΔH_f, kcal/mol:	-182.52
Dipole, Da:	5.54
IP(EA), eV:	-9.08(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[[4-(dimethylamino)benzoyl]amino]-3,3-dimethylbutanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)[C@H](C(=O)O)NC(=O)CCSC1=CC=CC=C1F

DOS

IR

Vibrations