Geometry & MOs

Info

ID:	150780
PubChem CID:	53790476
Reduced:	O3N4C12H30 (1)
Stoich.:	A3B4C12D30 (1)
Weight, g/mol:	416.194737
ΔH_f, kcal/mol:	-138.37
Dipole, Da:	4.4
IP(EA), eV:	-9.05(1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]cyclohexyl] 5-carbamimidoyl-1-benzofuran-2-carboxylate

Drug info:

PubChemData

Smile

C(CN(CCNCCO)CCNCCO)NCCO

DOS

IR

Vibrations