Geometry & MOs

Info

ID:	391627
PubChem CID:	135007307
Reduced:	NSO4C18H21 (1)
Stoich.:	ABC4D18E21 (1)
Weight, g/mol:	378.069063
ΔH_f, kcal/mol:	-134.78
Dipole, Da:	5.99
IP(EA), eV:	-9.04(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1,3,3,3-hexafluoropropan-2-yl 2-[(R)-hydroxy(naphthalen-1-yl)methyl]prop-2-enoate

Drug info:

PubChemData

Smile

CC1=C(C=C2CN(CC2C1)S(=O)(=O)C3=CC=C(C=C3)C)C(=O)OC

DOS

IR

Vibrations