Geometry & MOs

Info

ID:	181635
PubChem CID:	76767900
Reduced:	NO4C26H31 (1)
Stoich.:	AB4C26D31 (1)
Weight, g/mol:	349.112564
ΔH_f, kcal/mol:	-109.36
Dipole, Da:	4.86
IP(EA), eV:	-9.01(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,4-difluorophenyl)-N-(1,4-dihydroxy-2-oxopentan-3-yl)benzamide

Drug info:

PubChemData

Smile

CC(C)CCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)NC(C(C)O)C(=O)CO

DOS

IR

Vibrations