Geometry & MOs

Info

ID:	225254
PubChem CID:	85752925
Reduced:	NO5C17H25 (1)
Stoich.:	AB5C17D25 (1)
Weight, g/mol:	295.141973
ΔH_f, kcal/mol:	-220.11
Dipole, Da:	3.51
IP(EA), eV:	-9.01(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-amino-2-hexoxycarbonyloxybenzoate

Drug info:

PubChemData

Smile

CCCCCCCCOC(=O)OC1=C(C=CC(=C1)N)C(=O)OC

DOS

IR

Vibrations