Geometry & MOs

Info

ID:	70822
PubChem CID:	48413915
Reduced:	ON2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	316.153541
ΔH_f, kcal/mol:	-47.78
Dipole, Da:	3.52
IP(EA), eV:	-9.33(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-N-[2-[(5-methyl-1H-pyrazol-4-yl)methylamino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)NCC(=O)NCC2=C(NN=C2)C)C

DOS

IR

Vibrations