Geometry & MOs

Info

ID:	414139
PubChem CID:	135087094
Reduced:	NOH11C12 (1)
Stoich.:	ABC11D12 (1)
Weight, g/mol:	577.243054
ΔH_f, kcal/mol:	24.72
Dipole, Da:	6.59
IP(EA), eV:	-8.62(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[[1-[tert-butyl(dimethyl)silyl]indol-3-yl]-pyridin-3-ylmethyl]-(4-methylphenyl)sulfonylamino]acetate

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=C1C=C)C=O

DOS

IR

Vibrations