Geometry & MOs

Info

ID:	373689
PubChem CID:	131318801
Reduced:	NF2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	235.082013
ΔH_f, kcal/mol:	-109.63
Dipole, Da:	3.38
IP(EA), eV:	-9.29(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2R)-2-amino-1,1,1-trifluoropropan-2-yl]-2-methoxyphenol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)[C@@H](C(C)C)N)C(F)F

DOS

IR

Vibrations