Geometry & MOs

Info

ID:	372994
PubChem CID:	131308389
Reduced:	NOCl2H9C11 (1)
Stoich.:	ABC2D9E11 (1)
Weight, g/mol:	164.040819
ΔH_f, kcal/mol:	-24.42
Dipole, Da:	3.53
IP(EA), eV:	-8.76(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-pyrrol-1-ylthiophen-2-amine

Drug info:

PubChemData

Smile

CC1=C(C2=C(C=CC(=C2N1)Cl)Cl)CC=O

DOS

IR

Vibrations