Geometry & MOs

Info

ID:	323205
PubChem CID:	126673609
Reduced:	NO4C29H39 (1)
Stoich.:	AB4C29D39 (1)
Weight, g/mol:	641.161898
ΔH_f, kcal/mol:	-177.54
Dipole, Da:	4.82
IP(EA), eV:	-8.77(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (5R)-3-(3,6-difluorocarbazol-9-yl)-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC(C(=O)O)(C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)N

DOS

IR

Vibrations