Geometry & MOs

Info

ID:	203174
PubChem CID:	79790200
Reduced:	N2O4C15H20 (1)
Stoich.:	A2B4C15D20 (1)
Weight, g/mol:	291.0707
ΔH_f, kcal/mol:	-141.51
Dipole, Da:	6.35
IP(EA), eV:	-9.65(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[(2,4-difluorophenyl)methoxy]pyridin-2-yl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CCC(C)(C)NC(=O)COC1=CN=C(C=C1)C=CC(=O)O

DOS

IR

Vibrations