Geometry & MOs

Info

ID:	77021
PubChem CID:	48425715
Reduced:	N2O3C21H26 (1)
Stoich.:	A2B3C21D26 (1)
Weight, g/mol:	369.141259
ΔH_f, kcal/mol:	-96.76
Dipole, Da:	4.79
IP(EA), eV:	-8.63(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-1-pyridin-2-yl-5-(trifluoromethyl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CCOC1=CC=CC=C1C2=CC=CC=C2

DOS

IR

Vibrations