Geometry & MOs

Info

ID:	290566
PubChem CID:	104644089
Reduced:	NO3C11H23 (1)
Stoich.:	AB3C11D23 (1)
Weight, g/mol:	335.214367
ΔH_f, kcal/mol:	-164.72
Dipole, Da:	3.25
IP(EA), eV:	-9.54(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(dimethylamino)pyridin-3-yl]methyl]-1-ethyl-3-[(2-methylthiolan-2-yl)methyl]guanidine

Drug info:

PubChemData

Smile

CC(C)CCCNCC(C)(C(=O)OC)O

DOS

IR

Vibrations