Geometry & MOs

Info

ID:	34153
PubChem CID:	7890085
Reduced:	FN2O5C16H17 (1)
Stoich.:	AB2C5D16E17 (1)
Weight, g/mol:	329.137556
ΔH_f, kcal/mol:	-243.11
Dipole, Da:	4.06
IP(EA), eV:	-9.55(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(3,4-dimethylphenyl)ethyl]-2-(5-nitro-2-oxopyridin-1-yl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)COC(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations