Geometry & MOs

Info

ID:	417520
PubChem CID:	135098475
Reduced:	ClN3C14H22 (1)
Stoich.:	AB3C14D22 (1)
Weight, g/mol:	364.178693
ΔH_f, kcal/mol:	12.93
Dipole, Da:	2.44
IP(EA), eV:	-8.48(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,5R)-7-(2,2-diphenylacetyl)-9-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decan-10-one

Drug info:

PubChemData

Smile

CC(CCN(C)C1=C(C=CC=N1)Cl)N2CCCC2

DOS

IR

Vibrations