Geometry & MOs

Info

ID:	427610
PubChem CID:	135160568
Reduced:	N2O11C17H30 (1)
Stoich.:	A2B11C17D30 (1)
Weight, g/mol:	504.095388
ΔH_f, kcal/mol:	-441.28
Dipole, Da:	3.69
IP(EA), eV:	-9.78(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-O-(methoxymethyl) 6-O-(propan-2-yloxycarbonyloxymethyl) 3-[(3,4-dichlorophenyl)methoxy]bicyclo[3.1.0]hexane-2,6-dicarboxylate

Drug info:

PubChemData

Smile

CC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)OO)O)NC(=O)C)O)NC(=O)C

DOS

IR

Vibrations