Geometry & MOs

Info

ID:	199112
PubChem CID:	79200247
Reduced:	NO2C6H9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	264.147393
ΔH_f, kcal/mol:	-149.24
Dipole, Da:	5.37
IP(EA), eV:	-8.66(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]pentanamide

Drug info:

PubChemData

Smile

COCCOC1=NC=C(C=C1)NC(=O)CCCO

DOS

IR

Vibrations