Geometry & MOs

Info

ID:	224749
PubChem CID:	85349202
Reduced:	OSN2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	247.103085
ΔH_f, kcal/mol:	-26.77
Dipole, Da:	6.19
IP(EA), eV:	-8.95(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methoxy-1-[2-(4-methylsulfanylphenyl)cyclopenten-1-yl]methanimine

Drug info:

PubChemData

Smile

CCC1C(NC(=S)NC1=O)CC2=CC=CC=C2

DOS

IR

Vibrations