Geometry & MOs

Info

ID:	58423
PubChem CID:	24701143
Reduced:	NO3H9C11 (1)
Stoich.:	AB3C9D11 (1)
Weight, g/mol:	185.05105
ΔH_f, kcal/mol:	-41.69
Dipole, Da:	4.76
IP(EA), eV:	-10.27(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-3-(3-methylthiophen-2-yl)propanoic acid

Drug info:

PubChemData

Smile

C#CC(=O)NCC1=CC=C(C=C1)C(=O)O

DOS

IR

Vibrations