Geometry & MOs

Info

ID:	393519
PubChem CID:	135020885
Reduced:	ON4C10H12 (1)
Stoich.:	AB4C10D12 (1)
Weight, g/mol:	427.95001
ΔH_f, kcal/mol:	52.86
Dipole, Da:	5.96
IP(EA), eV:	-9.91(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(5-bromothiophen-2-yl)sulfonylamino]-3-(1H-indol-2-yl)propanoic acid

Drug info:

PubChemData

Smile

CC1=NN=NN1COCC2=CC=CC=C2

DOS

IR

Vibrations