Geometry & MOs

Info

ID:	76794
PubChem CID:	48425394
Reduced:	N2O2F3C17H23 (1)
Stoich.:	A2B2C3D17E23 (1)
Weight, g/mol:	266.174276
ΔH_f, kcal/mol:	-257.7
Dipole, Da:	6.56
IP(EA), eV:	-9.79(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-3-(4-methylpyrazol-1-yl)propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CC(C)C1=CC=C(C=C1)C(F)(F)F

DOS

IR

Vibrations