Geometry & MOs

Info

ID:	233261
PubChem CID:	89449555
Reduced:	O2F3N6H9C13 (1)
Stoich.:	A2B3C6D9E13 (1)
Weight, g/mol:	182.105528
ΔH_f, kcal/mol:	-74.33
Dipole, Da:	8.82
IP(EA), eV:	-9.38(-2.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-amino-4-ethylpyrrole-2-carboxylate

Drug info:

PubChemData

Smile

C1=C2C(=C3C=NN=C3)C(=CNN2C(=C1)NC(=O)C(F)(F)F)NC=O

DOS

IR

Vibrations