Geometry & MOs

Info

ID:	55064
PubChem CID:	17389720
Reduced:	ClN4C9H11 (1)
Stoich.:	AB4C9D11 (1)
Weight, g/mol:	207.012077
ΔH_f, kcal/mol:	33.7
Dipole, Da:	3.09
IP(EA), eV:	-9.0(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(aminomethyl)thiophene-2-carboxylate;hydrochloride

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=NC(=NN2)N.Cl

DOS

IR

Vibrations