Geometry & MOs

Info

ID:	385607
PubChem CID:	134979535
Reduced:	O5C15H22 (1)
Stoich.:	A5B15C22 (1)
Weight, g/mol:	389.183838
ΔH_f, kcal/mol:	-227.5
Dipole, Da:	2.94
IP(EA), eV:	-9.43(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1R,6S)-1-benzamido-6-ethoxycarbonyloxy-3,4-dimethylcyclohex-3-ene-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)[C@H]1CC(=CC[C@@]1(C=O)C(=O)OC(C)C)C

DOS

IR

Vibrations