Geometry & MOs

Info

ID:	76898
PubChem CID:	48425546
Reduced:	ON2C10H13 (2)
Stoich.:	AB2C10D13 (2)
Weight, g/mol:	300.158626
ΔH_f, kcal/mol:	-25.01
Dipole, Da:	2.49
IP(EA), eV:	-9.44(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-2-pyrazol-1-ylbenzamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(N(N=C1)C2=CC=CC=C2C)C3CC3

DOS

IR

Vibrations