Geometry & MOs

Info

ID:	287786
PubChem CID:	104294538
Reduced:	NSF2O3H11C14 (1)
Stoich.:	ABC2D3E11F14 (1)
Weight, g/mol:	283.102
ΔH_f, kcal/mol:	-190.01
Dipole, Da:	10.12
IP(EA), eV:	-9.12(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-2-[(2,4-difluoro-5-methylbenzoyl)amino]propanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)F)C(=O)NC2=CC(=C(S2)C(=O)O)C

DOS

IR

Vibrations