Geometry & MOs

Info

ID:	391841
PubChem CID:	135010128
Reduced:	NF3O4C17H18 (1)
Stoich.:	AB3C4D17E18 (1)
Weight, g/mol:	141.078979
ΔH_f, kcal/mol:	-305.37
Dipole, Da:	7.14
IP(EA), eV:	-9.37(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-3-methyl-4-oxobut-2-en-2-yl]acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=C(CCC1=O)NCC2=CC=CC=C2)(C(F)(F)F)O

DOS

IR

Vibrations