Geometry & MOs

Info

ID:	46474
PubChem CID:	10524585
Reduced:	ClO2N4H17C21 (1)
Stoich.:	AB2C4D17E21 (1)
Weight, g/mol:	231.083019
ΔH_f, kcal/mol:	88.9
Dipole, Da:	9.8
IP(EA), eV:	-8.46(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-(aminomethyl)phenyl]thiophene-2-carboximidamide

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=C(C=C1)C2=NN([N+](=N2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

DOS

IR

Vibrations