Geometry & MOs

Info

ID:	76929
PubChem CID:	48425588
Reduced:	O2N3C19H27 (1)
Stoich.:	A2B3C19D27 (1)
Weight, g/mol:	334.119654
ΔH_f, kcal/mol:	-79.02
Dipole, Da:	3.21
IP(EA), eV:	-8.5(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-N-[2-(diethylamino)-2-oxoethyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=CN(C2=CC=CC=C21)CC(C)C

DOS

IR

Vibrations