Geometry & MOs

Info

ID:	280945
PubChem CID:	103852094
Reduced:	SN3H13C17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	263.11217
ΔH_f, kcal/mol:	118.25
Dipole, Da:	4.74
IP(EA), eV:	-8.68(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-difluorophenyl)methyl]-2-methoxy-4-methylaniline

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CNC2=CC=CC(=C2)C3=NC=CS3)C#N

DOS

IR

Vibrations