Geometry & MOs

Info

ID:	69672
PubChem CID:	47205147
Reduced:	FO2N3C13H18 (1)
Stoich.:	AB2C3D13E18 (1)
Weight, g/mol:	292.072703
ΔH_f, kcal/mol:	-118.43
Dipole, Da:	0.89
IP(EA), eV:	-9.51(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[3-oxo-3-(pyridin-2-ylamino)propyl]-1H-pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N(C)C)NC(=O)NCC1=CC=CC=C1F

DOS

IR

Vibrations