Geometry & MOs

Info

ID:	77245
PubChem CID:	48425968
Reduced:	N3O3C16H27 (1)
Stoich.:	A3B3C16D27 (1)
Weight, g/mol:	306.13036
ΔH_f, kcal/mol:	-139.25
Dipole, Da:	6.67
IP(EA), eV:	-9.33(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1CCN(CC1)C(=O)C2CC2

DOS

IR

Vibrations