Geometry & MOs

Info

ID:	153627
PubChem CID:	56312897
Reduced:	FNO2C20H22 (1)
Stoich.:	ABC2D20E22 (1)
Weight, g/mol:	342.137971
ΔH_f, kcal/mol:	-83.92
Dipole, Da:	4.63
IP(EA), eV:	-9.03(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[2-(2-fluorophenyl)-2-methylpropyl]-3-(2-nitrophenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)/C=C/C1=CC(=CC=C1)OC)C2=CC=CC=C2F

DOS

IR

Vibrations