Geometry & MOs

Info

ID:	430201
PubChem CID:	135170264
Reduced:	ClSO3N5C21H24 (1)
Stoich.:	ABC3D5E21F24 (1)
Weight, g/mol:	314.199428
ΔH_f, kcal/mol:	52.19
Dipole, Da:	8.9
IP(EA), eV:	-9.4(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-ethylcyclopenten-1-yl)-4-methoxy-5-pyrrolidin-1-yloxyphenyl]methanimine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)Cl)S(=O)(=O)NC(C=C)C23CC[C@@H]2[C@@H]4[C@H]3CN(C4)C(=O)C5=NNN=C5

DOS

IR

Vibrations