Geometry & MOs

Info

ID:	174054
PubChem CID:	75715938
Reduced:	F3N3O5C23H24 (1)
Stoich.:	A3B3C5D23E24 (1)
Weight, g/mol:	375.179421
ΔH_f, kcal/mol:	-265.36
Dipole, Da:	6.57
IP(EA), eV:	-9.86(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclohexylamino)-1-oxopent-3-en-2-yl]-2-hydroxy-N-methyl-5-nitrobenzamide

Drug info:

PubChemData

Smile

CN(C(C1=CC=C(C=C1)C(F)(F)F)C(=O)NC2CCCCC2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])O

DOS

IR

Vibrations