Geometry & MOs

Info

ID:	199596
PubChem CID:	79268789
Reduced:	NO3C14H27 (1)
Stoich.:	AB3C14D27 (1)
Weight, g/mol:	338.06299
ΔH_f, kcal/mol:	-169.61
Dipole, Da:	3.3
IP(EA), eV:	-8.97(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromo-1H-indol-3-yl)methyl-tert-butylamino]acetic acid

Drug info:

PubChemData

Smile

CCC1(CC(CCO1)N(CC(=O)O)C(C)(C)C)C

DOS

IR

Vibrations