Geometry & MOs

Info

ID:	327054
PubChem CID:	126688930
Reduced:	O10C21H26 (1)
Stoich.:	A10B21C26 (1)
Weight, g/mol:	445.177038
ΔH_f, kcal/mol:	-422.54
Dipole, Da:	3.9
IP(EA), eV:	-9.65(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclohexanecarbonyloxymethoxycarbonylsulfanyl)ethylcarbamoyloxymethyl cyclohexanecarboxylate

Drug info:

PubChemData

Smile

CC(C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)OCC1=CC=CC=C1)OC(=O)C

DOS

IR

Vibrations