Geometry & MOs

Info

ID:	199110
PubChem CID:	79199768
Reduced:	ON2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	252.111007
ΔH_f, kcal/mol:	-40.04
Dipole, Da:	6.85
IP(EA), eV:	-8.85(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-N-(2-methyl-5-nitrophenyl)pentanamide

Drug info:

PubChemData

Smile

CC1=NC=CN1C2=NC=C(C=C2)NC(=O)CCCCO

DOS

IR

Vibrations