Geometry & MOs

Info

ID:	39509
PubChem CID:	8141085
Reduced:	ClO2F3N3H17C18 (1)
Stoich.:	AB2C3D3E17F18 (1)
Weight, g/mol:	349.108086
ΔH_f, kcal/mol:	-203.15
Dipole, Da:	4.57
IP(EA), eV:	-9.06(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chlorophenyl)methyl]-2,3,4-trimethoxy-N-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)O)C(=O)N2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

DOS

IR

Vibrations