Geometry & MOs

Info

ID:	227604
PubChem CID:	87562073
Reduced:	FN3O4C14H24 (1)
Stoich.:	AB3C4D14E24 (1)
Weight, g/mol:	247.132077
ΔH_f, kcal/mol:	-213.37
Dipole, Da:	6.46
IP(EA), eV:	-9.74(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-(1H-indol-3-yl)propanoic acid;aziridine

Drug info:

PubChemData

Smile

CCCC(N(CC/C(=N/OC(=O)C1CCCC1)/N)C(=O)O)F

DOS

IR

Vibrations