Geometry & MOs

Info

ID:	247154
PubChem CID:	103068256
Reduced:	OSN3C13H21 (1)
Stoich.:	ABC3D13E21 (1)
Weight, g/mol:	220.10342
ΔH_f, kcal/mol:	-19.79
Dipole, Da:	7.03
IP(EA), eV:	-9.04(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(pyridin-2-ylsulfanylmethyl)prop-2-enyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCCC1=CC(=O)N=C(N1)SCC(=C)CNCC

DOS

IR

Vibrations