Geometry & MOs

Info

ID:	342102
PubChem CID:	127264815
Reduced:	NF2O4H13C16 (1)
Stoich.:	AB2C4D13E16 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	-195.07
Dipole, Da:	4.47
IP(EA), eV:	-9.24(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[cyclopropyl(3-pyridin-2-ylprop-2-enoyl)amino]-2-methylpropanoic acid

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C=CC(=O)NC(C2=CC(=C(C=C2)F)F)C(=O)O

DOS

IR

Vibrations