Geometry & MOs

Info

ID:	18893
PubChem CID:	550717
Reduced:	SCl2N2O2H16C17 (1)
Stoich.:	AB2C2D2E16F17 (1)
Weight, g/mol:	382.030954
ΔH_f, kcal/mol:	-26.53
Dipole, Da:	6.58
IP(EA), eV:	-9.51(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dichlorophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)methanimine

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations