Geometry & MOs

Info

ID:	198545
PubChem CID:	79116558
Reduced:	SO2N3C15H25 (1)
Stoich.:	AB2C3D15E25 (1)
Weight, g/mol:	294.194343
ΔH_f, kcal/mol:	-63.39
Dipole, Da:	6.18
IP(EA), eV:	-8.82(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[[(4-aminocyclohexyl)-propylamino]methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

CCCNC1CCC(CC1)N(C)S(=O)(=O)C2=CN=CC=C2

DOS

IR

Vibrations