Geometry & MOs

Info

ID:	280951
PubChem CID:	103852118
Reduced:	ClFN2H12C13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	274.124819
ΔH_f, kcal/mol:	-7.01
Dipole, Da:	2.57
IP(EA), eV:	-8.73(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-chloro-4-fluorophenyl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1)NCC2=CC(=C(C=C2)F)Cl

DOS

IR

Vibrations