Geometry & MOs

Info

ID:	82419
PubChem CID:	49856011
Reduced:	NOC15H27 (1)
Stoich.:	ABC15D27 (1)
Weight, g/mol:	670.04902
ΔH_f, kcal/mol:	-81.2
Dipole, Da:	3.31
IP(EA), eV:	-8.89(0.79)
Spin(S_z, S²):	None, None
Charge, e:	4

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC[C@@H]1[C@@H]2[C@H](CCCN2C[C@H](C1=O)C)CC

DOS

IR

Vibrations