Geometry & MOs

Info

ID:	393219
PubChem CID:	135019763
Reduced:	NSiO2C18H29 (1)
Stoich.:	ABC2D18E29 (1)
Weight, g/mol:	686.389079
ΔH_f, kcal/mol:	-140.03
Dipole, Da:	3.95
IP(EA), eV:	-8.95(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,6R)-3,4,5-triacetyloxy-6-[4-[6-(3,5-ditert-butylanilino)hexyl]triazol-1-yl]oxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC[C@@H]1[C@@H](CC(=O)N1C)C2=CC=CC=C2

DOS

IR

Vibrations