Geometry & MOs

Info

ID:	189063
PubChem CID:	77812068
Reduced:	SN4O6C26H36 (1)
Stoich.:	AB4C6D26E36 (1)
Weight, g/mol:	332.150033
ΔH_f, kcal/mol:	-216.45
Dipole, Da:	8.05
IP(EA), eV:	-9.36(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-propylphenyl)-N-[[4-(1,1,2-trifluoroethyl)phenyl]methylideneamino]methanimine

Drug info:

PubChemData

Smile

CCCCC(C(N)S(=O)(=O)C1=CC=C(C=C1)C(=O)C(CC2=CC=C(C=C2)O)NC(=O)C3CNCCO3)N

DOS

IR

Vibrations