Geometry & MOs

Info

ID:	405274
PubChem CID:	135073324
Reduced:	NO2H13C17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	264.147393
ΔH_f, kcal/mol:	96.95
Dipole, Da:	5.5
IP(EA), eV:	-9.14(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-4-methyl-2-(pyridine-2-carbonylamino)pentyl] acetate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C#CC2=CC=CC=C2/C=C/[N+](=O)[O-]

DOS

IR

Vibrations