Geometry & MOs

Info

ID:	430294
PubChem CID:	135170358
Reduced:	SO3N4H24C30 (1)
Stoich.:	AB3C4D24E30 (1)
Weight, g/mol:	310.240899
ΔH_f, kcal/mol:	102.79
Dipole, Da:	5.12
IP(EA), eV:	-8.52(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methylcyclopenten-1-yl)-5-(4-pyrrolidin-1-ylbutyl)phenyl]methanimine

Drug info:

PubChemData

Smile

C#CCCC1(N=N1)CCNC(=O)C2=CC3=C(C=C2)C4=C(C3=O)C(SC5=CC=CC=C5N4)C6=CC(=CC=C6)O

DOS

IR

Vibrations