Geometry & MOs

Info

ID:	184763
PubChem CID:	77205141
Reduced:	NO9C26H39 (1)
Stoich.:	AB9C26D39 (1)
Weight, g/mol:	437.204967
ΔH_f, kcal/mol:	-412.79
Dipole, Da:	5.58
IP(EA), eV:	-9.12(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-[3,4-di(propanoyloxy)phenyl]-1-methoxy-1-oxopropan-2-yl]amino]ethyl butanoate

Drug info:

PubChemData

Smile

CCC(C)(C)C(=O)OC1=C(C=C(C=C1)CC(C(=O)OC(C)COC(=O)OC)N)OC(=O)C(C)(C)CC

DOS

IR

Vibrations