Geometry & MOs

Info

ID:	276107
PubChem CID:	103820617
Reduced:	BrNO2C17H24 (1)
Stoich.:	ABC2D17E24 (1)
Weight, g/mol:	298.132885
ΔH_f, kcal/mol:	-86.02
Dipole, Da:	4.53
IP(EA), eV:	-9.54(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-N-[2-(2-hydroxyethyl)pentyl]-2-nitrobenzamide

Drug info:

PubChemData

Smile

CCCC(CCO)CNC(=O)/C=C/C1=C(C=C(C=C1)C)Br

DOS

IR

Vibrations