Geometry & MOs

Info

ID:	302610
PubChem CID:	124385292
Reduced:	O3C17H30 (1)
Stoich.:	A3B17C30 (1)
Weight, g/mol:	273.195346
ΔH_f, kcal/mol:	-163.93
Dipole, Da:	3.81
IP(EA), eV:	-9.38(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyano-2-[(2S)-2-ethylhexyl]-3-pyridin-3-ylguanidine

Drug info:

PubChemData

Smile

CCCCC[C@H](/C=C/C=C/CCCCCCC(=O)O)O

DOS

IR

Vibrations