Geometry & MOs

Info

ID:	290542
PubChem CID:	104643535
Reduced:	ClN2O3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	297.074341
ΔH_f, kcal/mol:	-124.23
Dipole, Da:	3.61
IP(EA), eV:	-8.34(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-methoxy-6-[[methyl(3,3,3-trifluoropropyl)amino]methyl]phenol

Drug info:

PubChemData

Smile

CCCN(CC1=C(C(=CC(=C1)Cl)OC)O)CC(=O)NC

DOS

IR

Vibrations