Geometry & MOs

Info

ID:	145629
PubChem CID:	53560014
Reduced:	SN3O3C16H23 (1)
Stoich.:	AB3C3D16E23 (1)
Weight, g/mol:	345.155178
ΔH_f, kcal/mol:	-82.98
Dipole, Da:	6.38
IP(EA), eV:	-8.5(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methoxy-4-methylphenyl)-N-[1-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CN(C)S(=O)(=O)C2=C(N(N=C2C)C)C)OC

DOS

IR

Vibrations