Geometry & MOs

Info

ID:	29555
PubChem CID:	835116
Reduced:	N2F3O3H11C13 (1)
Stoich.:	A2B3C3D11E13 (1)
Weight, g/mol:	200.094963
ΔH_f, kcal/mol:	-244.82
Dipole, Da:	6.81
IP(EA), eV:	-9.03(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-pyrrol-1-ylphenyl)acetamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)C[C@H](C(=O)O)NC(=O)C(F)(F)F

DOS

IR

Vibrations