Geometry & MOs

Info

ID:	391437
PubChem CID:	135005090
Reduced:	NO3C25H25 (1)
Stoich.:	AB3C25D25 (1)
Weight, g/mol:	289.012667
ΔH_f, kcal/mol:	-38.9
Dipole, Da:	6.4
IP(EA), eV:	-7.96(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-1,1,1,3,3,3-hexafluoropropan-2-yl)sulfanyl-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2[C@H]([C@@H](C3C2=CC=CC=C3)C(=O)OC)C4=CC=C(C=C4)OC

DOS

IR

Vibrations