Geometry & MOs

Info

ID:	188238
PubChem CID:	77686951
Reduced:	SF3O5N6H25C26 (1)
Stoich.:	AB3C5D6E25F26 (1)
Weight, g/mol:	370.164105
ΔH_f, kcal/mol:	-277.78
Dipole, Da:	10.96
IP(EA), eV:	-9.27(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-(1H-imidazol-5-yl)propanoic acid;2-amino-3-naphthalen-1-ylpropanoic acid

Drug info:

PubChemData

Smile

CCNC(=O)NC1=NC=C(C(=C1)C2=NC(=CS2)C(F)(F)F)C3=NC=C4C(=C3)C(=O)C(=CN4C(CO)C(C)C)C(=O)O

DOS

IR

Vibrations