Geometry & MOs

Info

ID:	342101
PubChem CID:	127264814
Reduced:	NO4C14H19 (1)
Stoich.:	AB4C14D19 (1)
Weight, g/mol:	321.081264
ΔH_f, kcal/mol:	-147.27
Dipole, Da:	2.07
IP(EA), eV:	-9.28(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-difluorophenyl)-2-[3-(5-methylfuran-2-yl)prop-2-enoylamino]acetic acid

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)C=CC1=CC=CO1)C(=O)O

DOS

IR

Vibrations