Geometry & MOs

Info

ID:	327153
PubChem CID:	126689113
Reduced:	NO5C25H47 (1)
Stoich.:	AB5C25D47 (1)
Weight, g/mol:	479.288303
ΔH_f, kcal/mol:	-319.11
Dipole, Da:	5.11
IP(EA), eV:	-9.97(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 18-(4-nitrophenoxy)carbonyloxyoctadecanoate

Drug info:

PubChemData

Smile

COC(=O)CCCCCCCCCCCCCCCCC(=O)NCCCCCC(=O)O

DOS

IR

Vibrations