Geometry & MOs

Info

ID:	76973
PubChem CID:	48425646
Reduced:	O3N6C17H24 (1)
Stoich.:	A3B6C17D24 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-49.72
Dipole, Da:	3.16
IP(EA), eV:	-9.24(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-3-(2-ethoxyphenyl)-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CCC1=C(C=NN1C2=NN=C(C=C2)OC)C(=O)NCC(=O)N(CC)CC

DOS

IR

Vibrations