Geometry & MOs

Info

ID:	70798
PubChem CID:	48413885
Reduced:	SO3N4C20H22 (1)
Stoich.:	AB3C4D20E22 (1)
Weight, g/mol:	355.16444
ΔH_f, kcal/mol:	-50.21
Dipole, Da:	4.35
IP(EA), eV:	-9.05(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=C(NN=C3)C)C

DOS

IR

Vibrations