Geometry & MOs

Info

ID:	385611
PubChem CID:	134979542
Reduced:	O4C19H24 (1)
Stoich.:	A4B19C24 (1)
Weight, g/mol:	414.146072
ΔH_f, kcal/mol:	-126.8
Dipole, Da:	2.11
IP(EA), eV:	-9.53(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl N-[[(1S,6R)-6-formyl-3,6-dimethylcyclohex-2-en-1-yl]-methylsulfonylamino]-N-prop-2-enoxycarbonylcarbamate

Drug info:

PubChemData

Smile

C[C@]1([C@H](CC=C[C@H]1CCOCC2=CC=CC=C2)C(=O)OC)C=O

DOS

IR

Vibrations