Geometry & MOs

Info

ID:	188361
PubChem CID:	77704562
Reduced:	ClO4N5C34H40 (1)
Stoich.:	AB4C5D34E40 (1)
Weight, g/mol:	630.173726
ΔH_f, kcal/mol:	-107.37
Dipole, Da:	6.36
IP(EA), eV:	-8.46(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-acetyloxy-3,4-bis[(3-oxo-3-phenylpropanoyl)oxy]oxolan-2-yl]methyl 3-oxo-3-phenylpropanoate

Drug info:

PubChemData

Smile

CC(C1=CNC2=CC=CC=C21)C(C(=O)NC3=C(C=CC(=C3)CN(C)C)OC)NC(=O)N4CCC(CC4C5=CC=C(C=C5)Cl)O

DOS

IR

Vibrations