Geometry & MOs

Info

ID:	227374
PubChem CID:	87561559
Reduced:	N2O3C14H18 (1)
Stoich.:	A2B3C14D18 (1)
Weight, g/mol:	244.123008
ΔH_f, kcal/mol:	-80.71
Dipole, Da:	5.74
IP(EA), eV:	-8.66(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(1R,2S,5S)-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]ethoxy]acetyl chloride

Drug info:

PubChemData

Smile

CCCOC1=CC=CC=C1NN=C(C(=O)C)C(=O)C

DOS

IR

Vibrations