Geometry & MOs

Info

ID:	88830
PubChem CID:	49957062
Reduced:	FN2O3C26H27 (1)
Stoich.:	AB2C3D26E27 (1)
Weight, g/mol:	556.192212
ΔH_f, kcal/mol:	-123.47
Dipole, Da:	5.21
IP(EA), eV:	-8.98(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N'-bis[3-[(4-fluorophenyl)carbamoyl]phenyl]pentanediamide

Drug info:

PubChemData

Smile

CCC(C)C1=CC=CC=C1OC(C)C(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)F

DOS

IR

Vibrations