Geometry & MOs

Info

ID:	214235
PubChem CID:	84974743
Reduced:	F2N2O4H14C19 (1)
Stoich.:	A2B2C4D14E19 (1)
Weight, g/mol:	270.136828
ΔH_f, kcal/mol:	-165.22
Dipole, Da:	8.13
IP(EA), eV:	-9.28(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(dimethylamino)phenyl]methyl]-3-(furan-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=C(C=C1)F)F)OC(=O)C=CC2=NC3=CC=CC=C3O2

DOS

IR

Vibrations