Geometry & MOs

Info

ID:	63874
PubChem CID:	26759387
Reduced:	N2O6C17H24 (1)
Stoich.:	A2B6C17D24 (1)
Weight, g/mol:	418.137616
ΔH_f, kcal/mol:	-244.62
Dipole, Da:	3.88
IP(EA), eV:	-8.29(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl] 2-(3,4-dimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

CCCCNC(=O)NC(=O)COC(=O)CC1=CC(=C(C=C1)OC)OC

DOS

IR

Vibrations