Geometry & MOs

Info

ID:	293977
PubChem CID:	117420707
Reduced:	ClO3C14H15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	266.082205
ΔH_f, kcal/mol:	-122.75
Dipole, Da:	2.3
IP(EA), eV:	-9.06(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-4-(3-chloro-1-methylindol-5-yl)butanoic acid

Drug info:

PubChemData

Smile

C1CCC(C1)(C2=CC3=C(C(=C2)Cl)OCC3)C(=O)O

DOS

IR

Vibrations