Geometry & MOs

Info

ID:	394141
PubChem CID:	135022412
Reduced:	NO2S2C21H23 (1)
Stoich.:	AB2C2D21E23 (1)
Weight, g/mol:	427.090403
ΔH_f, kcal/mol:	-18.02
Dipole, Da:	5.38
IP(EA), eV:	-8.37(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3aR,4S,7aR)-2-(trichloromethyl)-4,7a-dihydro-3aH-pyrano[4,3-d][1,3]oxazol-4-yl]methoxy-tri(propan-2-yl)silane

Drug info:

PubChemData

Smile

CCC1=C(N(C(=C1C)CC=C)S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CS3

DOS

IR

Vibrations