Geometry & MOs

Info

ID:	341865
PubChem CID:	127264558
Reduced:	ClN2S2O4C7H15 (1)
Stoich.:	AB2C2D4E7F15 (1)
Weight, g/mol:	374.184172
ΔH_f, kcal/mol:	-206.26
Dipole, Da:	4.38
IP(EA), eV:	-8.99(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(2S)-2-acetamido-3-ethoxy-3-oxopropyl]indole-1-carboxylate

Drug info:

PubChemData

Smile

COC(=O)[C@@H](CSSC[C@H](C(=O)O)N)N.Cl

DOS

IR

Vibrations