Geometry & MOs

Info

ID:	154003
PubChem CID:	56313363
Reduced:	FN3O4H24C25 (1)
Stoich.:	AB3C4D24E25 (1)
Weight, g/mol:	359.184506
ΔH_f, kcal/mol:	-112.44
Dipole, Da:	6.24
IP(EA), eV:	-9.06(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[methyl(propan-2-ylcarbamoyl)amino]phenyl] 2-(3,5-dimethyl-1,2-oxazol-4-yl)propanoate

Drug info:

PubChemData

Smile

CC(C)NC(=O)N(C)C1=CC=C(C=C1)OC(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F

DOS

IR

Vibrations