Geometry & MOs

Info

ID:	147097
PubChem CID:	53786750
Reduced:	O2N3C5H13 (1)
Stoich.:	A2B3C5D13 (1)
Weight, g/mol:	210.089209
ΔH_f, kcal/mol:	-79.58
Dipole, Da:	4.31
IP(EA), eV:	-9.49(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-prop-2-enoxycarbonylbicyclo[2.1.1]hexane-2-carboxylic acid

Drug info:

PubChemData

Smile

CNC(C(=O)O)(NC)NC

DOS

IR

Vibrations