Geometry & MOs

Info

ID:	277283
PubChem CID:	103827628
Reduced:	NC4H7 (4)
Stoich.:	AB4C7 (4)
Weight, g/mol:	307.135448
ΔH_f, kcal/mol:	-0.72
Dipole, Da:	5.09
IP(EA), eV:	-8.63(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(2-ethylsulfinylethyl)-3-(1H-indol-3-yl)propanamide

Drug info:

PubChemData

Smile

CCCN(CC)CCNC1=NC=NC2=C1CCCCC2

DOS

IR

Vibrations