Geometry & MOs

Info

ID:	385663
PubChem CID:	134979670
Reduced:	O2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	209.141579
ΔH_f, kcal/mol:	-114.17
Dipole, Da:	2.49
IP(EA), eV:	-9.1(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S,4R)-N-tert-butyl-N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CCC[C@@H](C1)C(=O)[C@H](C(C)(C)C)O

DOS

IR

Vibrations