Geometry & MOs

Info

ID:	131745
PubChem CID:	51257773
Reduced:	SF2N2O2H14C15 (1)
Stoich.:	AB2C2D2E14F15 (1)
Weight, g/mol:	299.126991
ΔH_f, kcal/mol:	-140.55
Dipole, Da:	7.54
IP(EA), eV:	-9.22(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetamidophenyl)-4-acetyl-1-methylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=CN(C(=C1)C(=O)NC2=CC=C(C=C2)SC(F)F)C

DOS

IR

Vibrations