Geometry & MOs

Info

ID:	342097
PubChem CID:	127264810
Reduced:	NO4H15C16 (1)
Stoich.:	AB4C15D16 (1)
Weight, g/mol:	294.100442
ΔH_f, kcal/mol:	-111.4
Dipole, Da:	10.76
IP(EA), eV:	-9.06(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3-pyridin-4-ylprop-2-enoylamino)phenyl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CC1=C(OC(=C1)C(=O)NC2=CC=C(C=C2)C=CC(=O)O)C

DOS

IR

Vibrations