Geometry & MOs

Info

ID:

171382

PubChem CID:

75369542

Reduced:

FSN2O3C17H17 (1)

Stoich.:

ABC2D3E17F17 (1)

Weight, g/mol:

317.257946

ΔHf, kcal/mol:

-126.71

Dipole, Da:

5.21

IP(EA), eV:

-9.04(-0.53)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-ethyl-3-[3-(3-methylpiperidin-1-yl)propyl]-2-(pyridin-2-ylmethyl)guanidine

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CCOC(=O)C2CCN(C2=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations